data_51444 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51444 _Entry.Title ; Isoleucine d1-methyl chemical shift assignments for FhaC in lipid nanodiscs ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-05-14 _Entry.Accession_date 2022-05-14 _Entry.Last_release_date 2022-05-16 _Entry.Original_release_date 2022-05-16 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Giuseppe Sicoli . . . 0000-0003-4872-5660 51444 2 Albert Konijnenberg . . . . 51444 3 Jeremy Guerin . . . . 51444 4 Steve Hessmann . . . . 51444 5 Elise 'Del Nero' . . . . 51444 6 Oscar Hernandez-Alba . . . 0000-0001-5524-4983 51444 7 Sophie Lecher . . . . 51444 8 Guillaume Rouaut . . . . 51444 9 Linn Muggenburg . . . . 51444 10 Herve Vezin . . . 0000-0002-7282-2703 51444 11 Sarah Cianferani . . . 0000-0003-4013-4129 51444 12 Frank Sobott . . . 0000-0001-9029-1865 51444 13 Robert Schneider . . . 0000-0003-3279-5365 51444 14 Francoise Jacob-Dubuisson . . . 0000-0002-5102-1704 51444 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51444 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 15 51444 '1H chemical shifts' 45 51444 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2022-10-10 2022-05-14 update BMRB 'update entry citation' 51444 1 . . 2022-06-14 2022-05-14 original author 'original release' 51444 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 4QKY 'Crystal Structure Analysis of the Membrane Transporter FhaC' 51444 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51444 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 35936790 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Large-Scale Conformational Changes of FhaC Provide Insights Into the Two-Partner Secretion Mechanism ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Front. Mol. Biosci.' _Citation.Journal_name_full 'Frontiers in molecular biosciences' _Citation.Journal_volume 9 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN 2296-889X _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 950871 _Citation.Page_last 950871 _Citation.Year 2022 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Giuseppe Sicoli G. . . . 51444 1 2 Albert Konijnenberg A. . . . 51444 1 3 Jeremy Guerin J. . . . 51444 1 4 Steve Hessmann S. . . . 51444 1 5 Elise 'Del Nero' E. . . . 51444 1 6 Oscar Hernandez-Alba O. . . . 51444 1 7 Sophie Lecher S. . . . 51444 1 8 Guillaume Rouaut G. . . . 51444 1 9 Linn Muggenburg L. . . . 51444 1 10 Herve Vezin H. . . . 51444 1 11 Sarah Cianferani S. . . . 51444 1 12 Frank Sobott F. . . . 51444 1 13 Robert Schneider R. . . . 51444 1 14 Francoise Jacob-Dubuisson F. . . . 51444 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'two-partner secretion; Omp85 transporter; outer membrane; membrane protein' 51444 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51444 _Assembly.ID 1 _Assembly.Name FhaC _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states yes _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 61345 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 FhaC 1 $entity_1 . . yes native no no . . . 51444 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 4QKY . . X-ray 2.90 . . 51444 1 yes UniProt P35077 . . . . . . 51444 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID ; Protein transport. Member of a two partner secretion pathway (TPS) in which it mediates the secretion of filamentous hemagglutinin FHA (fhaB). ; 51444 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51444 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; QAQLLPGARDLNRIDDRQRK EQLQRDIERALTRPPVELNP QSEAAAPARKPDATSGHTVT VHAVDLDFGVEGRLFDPAPL VQDYLNRPLDNEQLFLLVKA LSAALYDRGYATSIVTFVPP GVVDGVLKLKVEWGRIKGWL IDGKPLEGTRDRMMVFSAMP GWQDKVLNVFDIDQAIYNIN NGGKTGNITIVPADEYGYSY LDLQLQRRALPRVSLGMDNS GPGTPENGRYKYNASVTAND LLGLNDTLGLYIGNRYYRDA GHDAERNYDLMYSVPLGRTR LDLQTGYSTYRNLLKTRYGQ YQSAGNSRSFGLKATRLLYR DTRSQFSVYGGLKLRQNKNY LAGTRLDVSSKHYSDVTVGM QYSTQRGANAYFGDLSFTRG VGVNNGKYAAYDERGPQGNV SRFNGSLAWTRYMALAGQPI QWASQLGFQYSRQQLLNSYQ ITVGDEYTVRGYNLRTSQSG DSGVYLSNTLTVPVQFSLLG KQASVAPFVGADVGALKSNH PDARTIRMAGLAAGVRFDLP YARMSFTYSKPVGAQPGGAP RAPVWLYINAGLSF ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states yes _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 554 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 61345 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes PDB 4QKY . FhaC . . . . . . . . . . . . . . 51444 1 2 yes UniProt P35077 . FhaC . . . . . . . . . . . . . . 51444 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID ; Protein transport. Member of a two partner secretion pathway (TPS) in which it mediates the secretion of filamentous hemagglutinin FHA (fhaB). ; 51444 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLN . 51444 1 2 . ALA . 51444 1 3 . GLN . 51444 1 4 . LEU . 51444 1 5 . LEU . 51444 1 6 . PRO . 51444 1 7 . GLY . 51444 1 8 . ALA . 51444 1 9 . ARG . 51444 1 10 . ASP . 51444 1 11 . LEU . 51444 1 12 . ASN . 51444 1 13 . ARG . 51444 1 14 . ILE . 51444 1 15 . ASP . 51444 1 16 . ASP . 51444 1 17 . ARG . 51444 1 18 . GLN . 51444 1 19 . ARG . 51444 1 20 . LYS . 51444 1 21 . GLU . 51444 1 22 . GLN . 51444 1 23 . LEU . 51444 1 24 . GLN . 51444 1 25 . ARG . 51444 1 26 . ASP . 51444 1 27 . ILE . 51444 1 28 . GLU . 51444 1 29 . ARG . 51444 1 30 . ALA . 51444 1 31 . LEU . 51444 1 32 . THR . 51444 1 33 . ARG . 51444 1 34 . PRO . 51444 1 35 . PRO . 51444 1 36 . VAL . 51444 1 37 . GLU . 51444 1 38 . LEU . 51444 1 39 . ASN . 51444 1 40 . PRO . 51444 1 41 . GLN . 51444 1 42 . SER . 51444 1 43 . GLU . 51444 1 44 . ALA . 51444 1 45 . ALA . 51444 1 46 . ALA . 51444 1 47 . PRO . 51444 1 48 . ALA . 51444 1 49 . ARG . 51444 1 50 . LYS . 51444 1 51 . PRO . 51444 1 52 . ASP . 51444 1 53 . ALA . 51444 1 54 . THR . 51444 1 55 . SER . 51444 1 56 . GLY . 51444 1 57 . HIS . 51444 1 58 . THR . 51444 1 59 . VAL . 51444 1 60 . THR . 51444 1 61 . VAL . 51444 1 62 . HIS . 51444 1 63 . ALA . 51444 1 64 . VAL . 51444 1 65 . ASP . 51444 1 66 . LEU . 51444 1 67 . ASP . 51444 1 68 . PHE . 51444 1 69 . GLY . 51444 1 70 . VAL . 51444 1 71 . GLU . 51444 1 72 . GLY . 51444 1 73 . ARG . 51444 1 74 . LEU . 51444 1 75 . PHE . 51444 1 76 . ASP . 51444 1 77 . PRO . 51444 1 78 . ALA . 51444 1 79 . PRO . 51444 1 80 . LEU . 51444 1 81 . VAL . 51444 1 82 . GLN . 51444 1 83 . ASP . 51444 1 84 . TYR . 51444 1 85 . LEU . 51444 1 86 . ASN . 51444 1 87 . ARG . 51444 1 88 . PRO . 51444 1 89 . LEU . 51444 1 90 . ASP . 51444 1 91 . ASN . 51444 1 92 . GLU . 51444 1 93 . GLN . 51444 1 94 . LEU . 51444 1 95 . PHE . 51444 1 96 . LEU . 51444 1 97 . LEU . 51444 1 98 . VAL . 51444 1 99 . LYS . 51444 1 100 . ALA . 51444 1 101 . LEU . 51444 1 102 . SER . 51444 1 103 . ALA . 51444 1 104 . ALA . 51444 1 105 . LEU . 51444 1 106 . TYR . 51444 1 107 . ASP . 51444 1 108 . ARG . 51444 1 109 . GLY . 51444 1 110 . TYR . 51444 1 111 . ALA . 51444 1 112 . THR . 51444 1 113 . SER . 51444 1 114 . ILE . 51444 1 115 . VAL . 51444 1 116 . THR . 51444 1 117 . PHE . 51444 1 118 . VAL . 51444 1 119 . PRO . 51444 1 120 . PRO . 51444 1 121 . GLY . 51444 1 122 . VAL . 51444 1 123 . VAL . 51444 1 124 . ASP . 51444 1 125 . GLY . 51444 1 126 . VAL . 51444 1 127 . LEU . 51444 1 128 . LYS . 51444 1 129 . LEU . 51444 1 130 . LYS . 51444 1 131 . VAL . 51444 1 132 . GLU . 51444 1 133 . TRP . 51444 1 134 . GLY . 51444 1 135 . ARG . 51444 1 136 . ILE . 51444 1 137 . LYS . 51444 1 138 . GLY . 51444 1 139 . TRP . 51444 1 140 . LEU . 51444 1 141 . ILE . 51444 1 142 . ASP . 51444 1 143 . GLY . 51444 1 144 . LYS . 51444 1 145 . PRO . 51444 1 146 . LEU . 51444 1 147 . GLU . 51444 1 148 . GLY . 51444 1 149 . THR . 51444 1 150 . ARG . 51444 1 151 . ASP . 51444 1 152 . ARG . 51444 1 153 . MET . 51444 1 154 . MET . 51444 1 155 . VAL . 51444 1 156 . PHE . 51444 1 157 . SER . 51444 1 158 . ALA . 51444 1 159 . MET . 51444 1 160 . PRO . 51444 1 161 . GLY . 51444 1 162 . TRP . 51444 1 163 . GLN . 51444 1 164 . ASP . 51444 1 165 . LYS . 51444 1 166 . VAL . 51444 1 167 . LEU . 51444 1 168 . ASN . 51444 1 169 . VAL . 51444 1 170 . PHE . 51444 1 171 . ASP . 51444 1 172 . ILE . 51444 1 173 . ASP . 51444 1 174 . GLN . 51444 1 175 . ALA . 51444 1 176 . ILE . 51444 1 177 . TYR . 51444 1 178 . ASN . 51444 1 179 . ILE . 51444 1 180 . ASN . 51444 1 181 . ASN . 51444 1 182 . GLY . 51444 1 183 . GLY . 51444 1 184 . LYS . 51444 1 185 . THR . 51444 1 186 . GLY . 51444 1 187 . ASN . 51444 1 188 . ILE . 51444 1 189 . THR . 51444 1 190 . ILE . 51444 1 191 . VAL . 51444 1 192 . PRO . 51444 1 193 . ALA . 51444 1 194 . ASP . 51444 1 195 . GLU . 51444 1 196 . TYR . 51444 1 197 . GLY . 51444 1 198 . TYR . 51444 1 199 . SER . 51444 1 200 . TYR . 51444 1 201 . LEU . 51444 1 202 . ASP . 51444 1 203 . LEU . 51444 1 204 . GLN . 51444 1 205 . LEU . 51444 1 206 . GLN . 51444 1 207 . ARG . 51444 1 208 . ARG . 51444 1 209 . ALA . 51444 1 210 . LEU . 51444 1 211 . PRO . 51444 1 212 . ARG . 51444 1 213 . VAL . 51444 1 214 . SER . 51444 1 215 . LEU . 51444 1 216 . GLY . 51444 1 217 . MET . 51444 1 218 . ASP . 51444 1 219 . ASN . 51444 1 220 . SER . 51444 1 221 . GLY . 51444 1 222 . PRO . 51444 1 223 . GLY . 51444 1 224 . THR . 51444 1 225 . PRO . 51444 1 226 . GLU . 51444 1 227 . ASN . 51444 1 228 . GLY . 51444 1 229 . ARG . 51444 1 230 . TYR . 51444 1 231 . LYS . 51444 1 232 . TYR . 51444 1 233 . ASN . 51444 1 234 . ALA . 51444 1 235 . SER . 51444 1 236 . VAL . 51444 1 237 . THR . 51444 1 238 . ALA . 51444 1 239 . ASN . 51444 1 240 . ASP . 51444 1 241 . LEU . 51444 1 242 . LEU . 51444 1 243 . GLY . 51444 1 244 . LEU . 51444 1 245 . ASN . 51444 1 246 . ASP . 51444 1 247 . THR . 51444 1 248 . LEU . 51444 1 249 . GLY . 51444 1 250 . LEU . 51444 1 251 . TYR . 51444 1 252 . ILE . 51444 1 253 . GLY . 51444 1 254 . ASN . 51444 1 255 . ARG . 51444 1 256 . TYR . 51444 1 257 . TYR . 51444 1 258 . ARG . 51444 1 259 . ASP . 51444 1 260 . ALA . 51444 1 261 . GLY . 51444 1 262 . HIS . 51444 1 263 . ASP . 51444 1 264 . ALA . 51444 1 265 . GLU . 51444 1 266 . ARG . 51444 1 267 . ASN . 51444 1 268 . TYR . 51444 1 269 . ASP . 51444 1 270 . LEU . 51444 1 271 . MET . 51444 1 272 . TYR . 51444 1 273 . SER . 51444 1 274 . VAL . 51444 1 275 . PRO . 51444 1 276 . LEU . 51444 1 277 . GLY . 51444 1 278 . ARG . 51444 1 279 . THR . 51444 1 280 . ARG . 51444 1 281 . LEU . 51444 1 282 . ASP . 51444 1 283 . LEU . 51444 1 284 . GLN . 51444 1 285 . THR . 51444 1 286 . GLY . 51444 1 287 . TYR . 51444 1 288 . SER . 51444 1 289 . THR . 51444 1 290 . TYR . 51444 1 291 . ARG . 51444 1 292 . ASN . 51444 1 293 . LEU . 51444 1 294 . LEU . 51444 1 295 . LYS . 51444 1 296 . THR . 51444 1 297 . ARG . 51444 1 298 . TYR . 51444 1 299 . GLY . 51444 1 300 . GLN . 51444 1 301 . TYR . 51444 1 302 . GLN . 51444 1 303 . SER . 51444 1 304 . ALA . 51444 1 305 . GLY . 51444 1 306 . ASN . 51444 1 307 . SER . 51444 1 308 . ARG . 51444 1 309 . SER . 51444 1 310 . PHE . 51444 1 311 . GLY . 51444 1 312 . LEU . 51444 1 313 . LYS . 51444 1 314 . ALA . 51444 1 315 . THR . 51444 1 316 . ARG . 51444 1 317 . LEU . 51444 1 318 . LEU . 51444 1 319 . TYR . 51444 1 320 . ARG . 51444 1 321 . ASP . 51444 1 322 . THR . 51444 1 323 . ARG . 51444 1 324 . SER . 51444 1 325 . GLN . 51444 1 326 . PHE . 51444 1 327 . SER . 51444 1 328 . VAL . 51444 1 329 . TYR . 51444 1 330 . GLY . 51444 1 331 . GLY . 51444 1 332 . LEU . 51444 1 333 . LYS . 51444 1 334 . LEU . 51444 1 335 . ARG . 51444 1 336 . GLN . 51444 1 337 . ASN . 51444 1 338 . LYS . 51444 1 339 . ASN . 51444 1 340 . TYR . 51444 1 341 . LEU . 51444 1 342 . ALA . 51444 1 343 . GLY . 51444 1 344 . THR . 51444 1 345 . ARG . 51444 1 346 . LEU . 51444 1 347 . ASP . 51444 1 348 . VAL . 51444 1 349 . SER . 51444 1 350 . SER . 51444 1 351 . LYS . 51444 1 352 . HIS . 51444 1 353 . TYR . 51444 1 354 . SER . 51444 1 355 . ASP . 51444 1 356 . VAL . 51444 1 357 . THR . 51444 1 358 . VAL . 51444 1 359 . GLY . 51444 1 360 . MET . 51444 1 361 . GLN . 51444 1 362 . TYR . 51444 1 363 . SER . 51444 1 364 . THR . 51444 1 365 . GLN . 51444 1 366 . ARG . 51444 1 367 . GLY . 51444 1 368 . ALA . 51444 1 369 . ASN . 51444 1 370 . ALA . 51444 1 371 . TYR . 51444 1 372 . PHE . 51444 1 373 . GLY . 51444 1 374 . ASP . 51444 1 375 . LEU . 51444 1 376 . SER . 51444 1 377 . PHE . 51444 1 378 . THR . 51444 1 379 . ARG . 51444 1 380 . GLY . 51444 1 381 . VAL . 51444 1 382 . GLY . 51444 1 383 . VAL . 51444 1 384 . ASN . 51444 1 385 . ASN . 51444 1 386 . GLY . 51444 1 387 . LYS . 51444 1 388 . TYR . 51444 1 389 . ALA . 51444 1 390 . ALA . 51444 1 391 . TYR . 51444 1 392 . ASP . 51444 1 393 . GLU . 51444 1 394 . ARG . 51444 1 395 . GLY . 51444 1 396 . PRO . 51444 1 397 . GLN . 51444 1 398 . GLY . 51444 1 399 . ASN . 51444 1 400 . VAL . 51444 1 401 . SER . 51444 1 402 . ARG . 51444 1 403 . PHE . 51444 1 404 . ASN . 51444 1 405 . GLY . 51444 1 406 . SER . 51444 1 407 . LEU . 51444 1 408 . ALA . 51444 1 409 . TRP . 51444 1 410 . THR . 51444 1 411 . ARG . 51444 1 412 . TYR . 51444 1 413 . MET . 51444 1 414 . ALA . 51444 1 415 . LEU . 51444 1 416 . ALA . 51444 1 417 . GLY . 51444 1 418 . GLN . 51444 1 419 . PRO . 51444 1 420 . ILE . 51444 1 421 . GLN . 51444 1 422 . TRP . 51444 1 423 . ALA . 51444 1 424 . SER . 51444 1 425 . GLN . 51444 1 426 . LEU . 51444 1 427 . GLY . 51444 1 428 . PHE . 51444 1 429 . GLN . 51444 1 430 . TYR . 51444 1 431 . SER . 51444 1 432 . ARG . 51444 1 433 . GLN . 51444 1 434 . GLN . 51444 1 435 . LEU . 51444 1 436 . LEU . 51444 1 437 . ASN . 51444 1 438 . SER . 51444 1 439 . TYR . 51444 1 440 . GLN . 51444 1 441 . ILE . 51444 1 442 . THR . 51444 1 443 . VAL . 51444 1 444 . GLY . 51444 1 445 . ASP . 51444 1 446 . GLU . 51444 1 447 . TYR . 51444 1 448 . THR . 51444 1 449 . VAL . 51444 1 450 . ARG . 51444 1 451 . GLY . 51444 1 452 . TYR . 51444 1 453 . ASN . 51444 1 454 . LEU . 51444 1 455 . ARG . 51444 1 456 . THR . 51444 1 457 . SER . 51444 1 458 . GLN . 51444 1 459 . SER . 51444 1 460 . GLY . 51444 1 461 . ASP . 51444 1 462 . SER . 51444 1 463 . GLY . 51444 1 464 . VAL . 51444 1 465 . TYR . 51444 1 466 . LEU . 51444 1 467 . SER . 51444 1 468 . ASN . 51444 1 469 . THR . 51444 1 470 . LEU . 51444 1 471 . THR . 51444 1 472 . VAL . 51444 1 473 . PRO . 51444 1 474 . VAL . 51444 1 475 . GLN . 51444 1 476 . PHE . 51444 1 477 . SER . 51444 1 478 . LEU . 51444 1 479 . LEU . 51444 1 480 . GLY . 51444 1 481 . LYS . 51444 1 482 . GLN . 51444 1 483 . ALA . 51444 1 484 . SER . 51444 1 485 . VAL . 51444 1 486 . ALA . 51444 1 487 . PRO . 51444 1 488 . PHE . 51444 1 489 . VAL . 51444 1 490 . GLY . 51444 1 491 . ALA . 51444 1 492 . ASP . 51444 1 493 . VAL . 51444 1 494 . GLY . 51444 1 495 . ALA . 51444 1 496 . LEU . 51444 1 497 . LYS . 51444 1 498 . SER . 51444 1 499 . ASN . 51444 1 500 . HIS . 51444 1 501 . PRO . 51444 1 502 . ASP . 51444 1 503 . ALA . 51444 1 504 . ARG . 51444 1 505 . THR . 51444 1 506 . ILE . 51444 1 507 . ARG . 51444 1 508 . MET . 51444 1 509 . ALA . 51444 1 510 . GLY . 51444 1 511 . LEU . 51444 1 512 . ALA . 51444 1 513 . ALA . 51444 1 514 . GLY . 51444 1 515 . VAL . 51444 1 516 . ARG . 51444 1 517 . PHE . 51444 1 518 . ASP . 51444 1 519 . LEU . 51444 1 520 . PRO . 51444 1 521 . TYR . 51444 1 522 . ALA . 51444 1 523 . ARG . 51444 1 524 . MET . 51444 1 525 . SER . 51444 1 526 . PHE . 51444 1 527 . THR . 51444 1 528 . TYR . 51444 1 529 . SER . 51444 1 530 . LYS . 51444 1 531 . PRO . 51444 1 532 . VAL . 51444 1 533 . GLY . 51444 1 534 . ALA . 51444 1 535 . GLN . 51444 1 536 . PRO . 51444 1 537 . GLY . 51444 1 538 . GLY . 51444 1 539 . ALA . 51444 1 540 . PRO . 51444 1 541 . ARG . 51444 1 542 . ALA . 51444 1 543 . PRO . 51444 1 544 . VAL . 51444 1 545 . TRP . 51444 1 546 . LEU . 51444 1 547 . TYR . 51444 1 548 . ILE . 51444 1 549 . ASN . 51444 1 550 . ALA . 51444 1 551 . GLY . 51444 1 552 . LEU . 51444 1 553 . SER . 51444 1 554 . PHE . 51444 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLN 1 1 51444 1 . ALA 2 2 51444 1 . GLN 3 3 51444 1 . LEU 4 4 51444 1 . LEU 5 5 51444 1 . PRO 6 6 51444 1 . GLY 7 7 51444 1 . ALA 8 8 51444 1 . ARG 9 9 51444 1 . ASP 10 10 51444 1 . LEU 11 11 51444 1 . ASN 12 12 51444 1 . ARG 13 13 51444 1 . ILE 14 14 51444 1 . ASP 15 15 51444 1 . ASP 16 16 51444 1 . ARG 17 17 51444 1 . GLN 18 18 51444 1 . ARG 19 19 51444 1 . LYS 20 20 51444 1 . GLU 21 21 51444 1 . GLN 22 22 51444 1 . LEU 23 23 51444 1 . GLN 24 24 51444 1 . ARG 25 25 51444 1 . ASP 26 26 51444 1 . ILE 27 27 51444 1 . GLU 28 28 51444 1 . ARG 29 29 51444 1 . ALA 30 30 51444 1 . LEU 31 31 51444 1 . THR 32 32 51444 1 . ARG 33 33 51444 1 . PRO 34 34 51444 1 . PRO 35 35 51444 1 . VAL 36 36 51444 1 . GLU 37 37 51444 1 . LEU 38 38 51444 1 . ASN 39 39 51444 1 . PRO 40 40 51444 1 . GLN 41 41 51444 1 . SER 42 42 51444 1 . GLU 43 43 51444 1 . ALA 44 44 51444 1 . ALA 45 45 51444 1 . ALA 46 46 51444 1 . PRO 47 47 51444 1 . ALA 48 48 51444 1 . ARG 49 49 51444 1 . LYS 50 50 51444 1 . PRO 51 51 51444 1 . ASP 52 52 51444 1 . ALA 53 53 51444 1 . THR 54 54 51444 1 . SER 55 55 51444 1 . GLY 56 56 51444 1 . HIS 57 57 51444 1 . THR 58 58 51444 1 . VAL 59 59 51444 1 . THR 60 60 51444 1 . VAL 61 61 51444 1 . HIS 62 62 51444 1 . ALA 63 63 51444 1 . VAL 64 64 51444 1 . ASP 65 65 51444 1 . LEU 66 66 51444 1 . ASP 67 67 51444 1 . PHE 68 68 51444 1 . GLY 69 69 51444 1 . VAL 70 70 51444 1 . GLU 71 71 51444 1 . GLY 72 72 51444 1 . ARG 73 73 51444 1 . LEU 74 74 51444 1 . PHE 75 75 51444 1 . ASP 76 76 51444 1 . PRO 77 77 51444 1 . ALA 78 78 51444 1 . PRO 79 79 51444 1 . LEU 80 80 51444 1 . VAL 81 81 51444 1 . GLN 82 82 51444 1 . ASP 83 83 51444 1 . TYR 84 84 51444 1 . LEU 85 85 51444 1 . ASN 86 86 51444 1 . ARG 87 87 51444 1 . PRO 88 88 51444 1 . LEU 89 89 51444 1 . ASP 90 90 51444 1 . ASN 91 91 51444 1 . GLU 92 92 51444 1 . GLN 93 93 51444 1 . LEU 94 94 51444 1 . PHE 95 95 51444 1 . LEU 96 96 51444 1 . LEU 97 97 51444 1 . VAL 98 98 51444 1 . LYS 99 99 51444 1 . ALA 100 100 51444 1 . LEU 101 101 51444 1 . SER 102 102 51444 1 . ALA 103 103 51444 1 . ALA 104 104 51444 1 . LEU 105 105 51444 1 . TYR 106 106 51444 1 . ASP 107 107 51444 1 . ARG 108 108 51444 1 . GLY 109 109 51444 1 . TYR 110 110 51444 1 . ALA 111 111 51444 1 . THR 112 112 51444 1 . SER 113 113 51444 1 . ILE 114 114 51444 1 . VAL 115 115 51444 1 . THR 116 116 51444 1 . PHE 117 117 51444 1 . VAL 118 118 51444 1 . PRO 119 119 51444 1 . PRO 120 120 51444 1 . GLY 121 121 51444 1 . VAL 122 122 51444 1 . VAL 123 123 51444 1 . ASP 124 124 51444 1 . GLY 125 125 51444 1 . VAL 126 126 51444 1 . LEU 127 127 51444 1 . LYS 128 128 51444 1 . LEU 129 129 51444 1 . LYS 130 130 51444 1 . VAL 131 131 51444 1 . GLU 132 132 51444 1 . TRP 133 133 51444 1 . GLY 134 134 51444 1 . ARG 135 135 51444 1 . ILE 136 136 51444 1 . LYS 137 137 51444 1 . GLY 138 138 51444 1 . TRP 139 139 51444 1 . LEU 140 140 51444 1 . ILE 141 141 51444 1 . ASP 142 142 51444 1 . GLY 143 143 51444 1 . LYS 144 144 51444 1 . PRO 145 145 51444 1 . LEU 146 146 51444 1 . GLU 147 147 51444 1 . GLY 148 148 51444 1 . THR 149 149 51444 1 . ARG 150 150 51444 1 . ASP 151 151 51444 1 . ARG 152 152 51444 1 . MET 153 153 51444 1 . MET 154 154 51444 1 . VAL 155 155 51444 1 . PHE 156 156 51444 1 . SER 157 157 51444 1 . ALA 158 158 51444 1 . MET 159 159 51444 1 . PRO 160 160 51444 1 . GLY 161 161 51444 1 . TRP 162 162 51444 1 . GLN 163 163 51444 1 . ASP 164 164 51444 1 . LYS 165 165 51444 1 . VAL 166 166 51444 1 . LEU 167 167 51444 1 . ASN 168 168 51444 1 . VAL 169 169 51444 1 . PHE 170 170 51444 1 . ASP 171 171 51444 1 . ILE 172 172 51444 1 . ASP 173 173 51444 1 . GLN 174 174 51444 1 . ALA 175 175 51444 1 . ILE 176 176 51444 1 . TYR 177 177 51444 1 . ASN 178 178 51444 1 . ILE 179 179 51444 1 . ASN 180 180 51444 1 . ASN 181 181 51444 1 . GLY 182 182 51444 1 . GLY 183 183 51444 1 . LYS 184 184 51444 1 . THR 185 185 51444 1 . GLY 186 186 51444 1 . ASN 187 187 51444 1 . ILE 188 188 51444 1 . THR 189 189 51444 1 . ILE 190 190 51444 1 . VAL 191 191 51444 1 . PRO 192 192 51444 1 . ALA 193 193 51444 1 . ASP 194 194 51444 1 . GLU 195 195 51444 1 . TYR 196 196 51444 1 . GLY 197 197 51444 1 . TYR 198 198 51444 1 . SER 199 199 51444 1 . TYR 200 200 51444 1 . LEU 201 201 51444 1 . ASP 202 202 51444 1 . LEU 203 203 51444 1 . GLN 204 204 51444 1 . LEU 205 205 51444 1 . GLN 206 206 51444 1 . ARG 207 207 51444 1 . ARG 208 208 51444 1 . ALA 209 209 51444 1 . LEU 210 210 51444 1 . PRO 211 211 51444 1 . ARG 212 212 51444 1 . VAL 213 213 51444 1 . SER 214 214 51444 1 . LEU 215 215 51444 1 . GLY 216 216 51444 1 . MET 217 217 51444 1 . ASP 218 218 51444 1 . ASN 219 219 51444 1 . SER 220 220 51444 1 . GLY 221 221 51444 1 . PRO 222 222 51444 1 . GLY 223 223 51444 1 . THR 224 224 51444 1 . PRO 225 225 51444 1 . GLU 226 226 51444 1 . ASN 227 227 51444 1 . GLY 228 228 51444 1 . ARG 229 229 51444 1 . TYR 230 230 51444 1 . LYS 231 231 51444 1 . TYR 232 232 51444 1 . ASN 233 233 51444 1 . ALA 234 234 51444 1 . SER 235 235 51444 1 . VAL 236 236 51444 1 . THR 237 237 51444 1 . ALA 238 238 51444 1 . ASN 239 239 51444 1 . ASP 240 240 51444 1 . LEU 241 241 51444 1 . LEU 242 242 51444 1 . GLY 243 243 51444 1 . LEU 244 244 51444 1 . ASN 245 245 51444 1 . ASP 246 246 51444 1 . THR 247 247 51444 1 . LEU 248 248 51444 1 . GLY 249 249 51444 1 . LEU 250 250 51444 1 . TYR 251 251 51444 1 . ILE 252 252 51444 1 . GLY 253 253 51444 1 . ASN 254 254 51444 1 . ARG 255 255 51444 1 . TYR 256 256 51444 1 . TYR 257 257 51444 1 . ARG 258 258 51444 1 . ASP 259 259 51444 1 . ALA 260 260 51444 1 . GLY 261 261 51444 1 . HIS 262 262 51444 1 . ASP 263 263 51444 1 . ALA 264 264 51444 1 . GLU 265 265 51444 1 . ARG 266 266 51444 1 . ASN 267 267 51444 1 . TYR 268 268 51444 1 . ASP 269 269 51444 1 . LEU 270 270 51444 1 . MET 271 271 51444 1 . TYR 272 272 51444 1 . SER 273 273 51444 1 . VAL 274 274 51444 1 . PRO 275 275 51444 1 . LEU 276 276 51444 1 . GLY 277 277 51444 1 . ARG 278 278 51444 1 . THR 279 279 51444 1 . ARG 280 280 51444 1 . LEU 281 281 51444 1 . ASP 282 282 51444 1 . LEU 283 283 51444 1 . GLN 284 284 51444 1 . THR 285 285 51444 1 . GLY 286 286 51444 1 . TYR 287 287 51444 1 . SER 288 288 51444 1 . THR 289 289 51444 1 . TYR 290 290 51444 1 . ARG 291 291 51444 1 . ASN 292 292 51444 1 . LEU 293 293 51444 1 . LEU 294 294 51444 1 . LYS 295 295 51444 1 . THR 296 296 51444 1 . ARG 297 297 51444 1 . TYR 298 298 51444 1 . GLY 299 299 51444 1 . GLN 300 300 51444 1 . TYR 301 301 51444 1 . GLN 302 302 51444 1 . SER 303 303 51444 1 . ALA 304 304 51444 1 . GLY 305 305 51444 1 . ASN 306 306 51444 1 . SER 307 307 51444 1 . ARG 308 308 51444 1 . SER 309 309 51444 1 . PHE 310 310 51444 1 . GLY 311 311 51444 1 . LEU 312 312 51444 1 . LYS 313 313 51444 1 . ALA 314 314 51444 1 . THR 315 315 51444 1 . ARG 316 316 51444 1 . LEU 317 317 51444 1 . LEU 318 318 51444 1 . TYR 319 319 51444 1 . ARG 320 320 51444 1 . ASP 321 321 51444 1 . THR 322 322 51444 1 . ARG 323 323 51444 1 . SER 324 324 51444 1 . GLN 325 325 51444 1 . PHE 326 326 51444 1 . SER 327 327 51444 1 . VAL 328 328 51444 1 . TYR 329 329 51444 1 . GLY 330 330 51444 1 . GLY 331 331 51444 1 . LEU 332 332 51444 1 . LYS 333 333 51444 1 . LEU 334 334 51444 1 . ARG 335 335 51444 1 . GLN 336 336 51444 1 . ASN 337 337 51444 1 . LYS 338 338 51444 1 . ASN 339 339 51444 1 . TYR 340 340 51444 1 . LEU 341 341 51444 1 . ALA 342 342 51444 1 . GLY 343 343 51444 1 . THR 344 344 51444 1 . ARG 345 345 51444 1 . LEU 346 346 51444 1 . ASP 347 347 51444 1 . VAL 348 348 51444 1 . SER 349 349 51444 1 . SER 350 350 51444 1 . LYS 351 351 51444 1 . HIS 352 352 51444 1 . TYR 353 353 51444 1 . SER 354 354 51444 1 . ASP 355 355 51444 1 . VAL 356 356 51444 1 . THR 357 357 51444 1 . VAL 358 358 51444 1 . GLY 359 359 51444 1 . MET 360 360 51444 1 . GLN 361 361 51444 1 . TYR 362 362 51444 1 . SER 363 363 51444 1 . THR 364 364 51444 1 . GLN 365 365 51444 1 . ARG 366 366 51444 1 . GLY 367 367 51444 1 . ALA 368 368 51444 1 . ASN 369 369 51444 1 . ALA 370 370 51444 1 . TYR 371 371 51444 1 . PHE 372 372 51444 1 . GLY 373 373 51444 1 . ASP 374 374 51444 1 . LEU 375 375 51444 1 . SER 376 376 51444 1 . PHE 377 377 51444 1 . THR 378 378 51444 1 . ARG 379 379 51444 1 . GLY 380 380 51444 1 . VAL 381 381 51444 1 . GLY 382 382 51444 1 . VAL 383 383 51444 1 . ASN 384 384 51444 1 . ASN 385 385 51444 1 . GLY 386 386 51444 1 . LYS 387 387 51444 1 . TYR 388 388 51444 1 . ALA 389 389 51444 1 . ALA 390 390 51444 1 . TYR 391 391 51444 1 . ASP 392 392 51444 1 . GLU 393 393 51444 1 . ARG 394 394 51444 1 . GLY 395 395 51444 1 . PRO 396 396 51444 1 . GLN 397 397 51444 1 . GLY 398 398 51444 1 . ASN 399 399 51444 1 . VAL 400 400 51444 1 . SER 401 401 51444 1 . ARG 402 402 51444 1 . PHE 403 403 51444 1 . ASN 404 404 51444 1 . GLY 405 405 51444 1 . SER 406 406 51444 1 . LEU 407 407 51444 1 . ALA 408 408 51444 1 . TRP 409 409 51444 1 . THR 410 410 51444 1 . ARG 411 411 51444 1 . TYR 412 412 51444 1 . MET 413 413 51444 1 . ALA 414 414 51444 1 . LEU 415 415 51444 1 . ALA 416 416 51444 1 . GLY 417 417 51444 1 . GLN 418 418 51444 1 . PRO 419 419 51444 1 . ILE 420 420 51444 1 . GLN 421 421 51444 1 . TRP 422 422 51444 1 . ALA 423 423 51444 1 . SER 424 424 51444 1 . GLN 425 425 51444 1 . LEU 426 426 51444 1 . GLY 427 427 51444 1 . PHE 428 428 51444 1 . GLN 429 429 51444 1 . TYR 430 430 51444 1 . SER 431 431 51444 1 . ARG 432 432 51444 1 . GLN 433 433 51444 1 . GLN 434 434 51444 1 . LEU 435 435 51444 1 . LEU 436 436 51444 1 . ASN 437 437 51444 1 . SER 438 438 51444 1 . TYR 439 439 51444 1 . GLN 440 440 51444 1 . ILE 441 441 51444 1 . THR 442 442 51444 1 . VAL 443 443 51444 1 . GLY 444 444 51444 1 . ASP 445 445 51444 1 . GLU 446 446 51444 1 . TYR 447 447 51444 1 . THR 448 448 51444 1 . VAL 449 449 51444 1 . ARG 450 450 51444 1 . GLY 451 451 51444 1 . TYR 452 452 51444 1 . ASN 453 453 51444 1 . LEU 454 454 51444 1 . ARG 455 455 51444 1 . THR 456 456 51444 1 . SER 457 457 51444 1 . GLN 458 458 51444 1 . SER 459 459 51444 1 . GLY 460 460 51444 1 . ASP 461 461 51444 1 . SER 462 462 51444 1 . GLY 463 463 51444 1 . VAL 464 464 51444 1 . TYR 465 465 51444 1 . LEU 466 466 51444 1 . SER 467 467 51444 1 . ASN 468 468 51444 1 . THR 469 469 51444 1 . LEU 470 470 51444 1 . THR 471 471 51444 1 . VAL 472 472 51444 1 . PRO 473 473 51444 1 . VAL 474 474 51444 1 . GLN 475 475 51444 1 . PHE 476 476 51444 1 . SER 477 477 51444 1 . LEU 478 478 51444 1 . LEU 479 479 51444 1 . GLY 480 480 51444 1 . LYS 481 481 51444 1 . GLN 482 482 51444 1 . ALA 483 483 51444 1 . SER 484 484 51444 1 . VAL 485 485 51444 1 . ALA 486 486 51444 1 . PRO 487 487 51444 1 . PHE 488 488 51444 1 . VAL 489 489 51444 1 . GLY 490 490 51444 1 . ALA 491 491 51444 1 . ASP 492 492 51444 1 . VAL 493 493 51444 1 . GLY 494 494 51444 1 . ALA 495 495 51444 1 . LEU 496 496 51444 1 . LYS 497 497 51444 1 . SER 498 498 51444 1 . ASN 499 499 51444 1 . HIS 500 500 51444 1 . PRO 501 501 51444 1 . ASP 502 502 51444 1 . ALA 503 503 51444 1 . ARG 504 504 51444 1 . THR 505 505 51444 1 . ILE 506 506 51444 1 . ARG 507 507 51444 1 . MET 508 508 51444 1 . ALA 509 509 51444 1 . GLY 510 510 51444 1 . LEU 511 511 51444 1 . ALA 512 512 51444 1 . ALA 513 513 51444 1 . GLY 514 514 51444 1 . VAL 515 515 51444 1 . ARG 516 516 51444 1 . PHE 517 517 51444 1 . ASP 518 518 51444 1 . LEU 519 519 51444 1 . PRO 520 520 51444 1 . TYR 521 521 51444 1 . ALA 522 522 51444 1 . ARG 523 523 51444 1 . MET 524 524 51444 1 . SER 525 525 51444 1 . PHE 526 526 51444 1 . THR 527 527 51444 1 . TYR 528 528 51444 1 . SER 529 529 51444 1 . LYS 530 530 51444 1 . PRO 531 531 51444 1 . VAL 532 532 51444 1 . GLY 533 533 51444 1 . ALA 534 534 51444 1 . GLN 535 535 51444 1 . PRO 536 536 51444 1 . GLY 537 537 51444 1 . GLY 538 538 51444 1 . ALA 539 539 51444 1 . PRO 540 540 51444 1 . ARG 541 541 51444 1 . ALA 542 542 51444 1 . PRO 543 543 51444 1 . VAL 544 544 51444 1 . TRP 545 545 51444 1 . LEU 546 546 51444 1 . TYR 547 547 51444 1 . ILE 548 548 51444 1 . ASN 549 549 51444 1 . ALA 550 550 51444 1 . GLY 551 551 51444 1 . LEU 552 552 51444 1 . SER 553 553 51444 1 . PHE 554 554 51444 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51444 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 520 organism . 'Bordetella pertussis' 'Bordetella pertussis' . . Bacteria . Bordetella pertussis 'Tohama I' . . . . . . . . . . fhaC . 51444 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51444 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) omp5 . plasmid . . pT7FcW . . . 51444 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51444 _Sample.ID 1 _Sample.Name FhaC _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 FhaC '[U-2H; U-15N; U-(13CD,1HD)Ile]' . . 1 $entity_1 . . 90 . . uM . . . . 51444 1 2 MSP1D1 [U-2H] . . . . . . 270 . . uM . . . . 51444 1 3 DMPC [U-2H] . . . . . . 11.3 . . mM . . . . 51444 1 4 DMPG [U-2H] . . . . . . 4.9 . . mM . . . . 51444 1 5 DSS 'natural abundance' . . . . . . 140 . . uM . . . . 51444 1 6 'sodium phosphate' 'natural abundance' . . . . . . 100 . . mM . . . . 51444 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 51444 _Sample.ID 2 _Sample.Name 'FhaC I176V' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 2 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'FhaC I176V' '[U-2H; U-15N; U-(13CD,1HD)Ile]' . . 1 $entity_1 . . 56 . . uM . . . . 51444 2 2 MSP1D1 [U-2H] . . . . . . 168 . . uM . . . . 51444 2 3 DMPC [U-2H] . . . . . . 7.0 . . mM . . . . 51444 2 4 DMPG [U-2H] . . . . . . 3.0 . . mM . . . . 51444 2 5 DSS 'natural abundance' . . . . . . 140 . . uM . . . . 51444 2 6 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51444 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 51444 _Sample.ID 3 _Sample.Name 'FhaC I172V' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 3 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'FhaC I176V' '[U-2H; U-15N; U-(13CD,1HD)Ile]' . . 1 $entity_1 . . 56 . . uM . . . . 51444 3 2 MSP1D1 [U-2H] . . . . . . 168 . . uM . . . . 51444 3 3 DMPC [U-2H] . . . . . . 7.0 . . mM . . . . 51444 3 4 DMPG [U-2H] . . . . . . 3.0 . . mM . . . . 51444 3 5 DSS 'natural abundance' . . . . . . 140 . . uM . . . . 51444 3 6 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51444 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 51444 _Sample.ID 4 _Sample.Name 'FhaC C195-MTSL' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 4 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'FhaC C195-MTSL' '[U-2H; U-15N; U-(13CD,1HD)Ile]' . . 1 $entity_1 . . 90 . . uM . . . . 51444 4 2 MSP1D1 [U-2H] . . . . . . 270 . . uM . . . . 51444 4 3 DMPC [U-2H] . . . . . . 11.3 . . mM . . . . 51444 4 4 DMPG [U-2H] . . . . . . 4.9 . . mM . . . . 51444 4 5 DSS 'natural abundance' . . . . . . 140 . . uM . . . . 51444 4 6 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51444 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID 51444 _Sample.ID 5 _Sample.Name 'FhaC C195-MTSL reduced' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 5 _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'FhaC C195-MTSL' '[U-2H; U-15N; U-(13CD,1HD)Ile]' . . 1 $entity_1 . . 88 . . uM . . . . 51444 5 2 MSP1D1 [U-2H] . . . . . . 265 . . uM . . . . 51444 5 3 DMPC [U-2H] . . . . . . 11.1 . . mM . . . . 51444 5 4 DMPG [U-2H] . . . . . . 4.8 . . mM . . . . 51444 5 5 DSS 'natural abundance' . . . . . . 137 . . uM . . . . 51444 5 6 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51444 5 7 ascorbate 'natural abundance' . . . . . . 880 . . uM . . . . 51444 5 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51444 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Nanodisc experiments in solution, 50 mM' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 50 . mM 51444 1 pH* 7.2 . pH 51444 1 pressure 1 . atm 51444 1 temperature 305 . K 51444 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 51444 _Sample_condition_list.ID 2 _Sample_condition_list.Name 'Nanodisc experiments in solution, 100 mM' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 51444 2 pH* 7.2 . pH 51444 2 pressure 1 . atm 51444 2 temperature 305 . K 51444 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51444 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 4.0.3 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51444 1 processing . 51444 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51444 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version 10.6 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51444 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 51444 _Software.ID 3 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version 1.4 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51444 3 'data analysis' . 51444 3 'peak picking' . 51444 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 51444 _Software.ID 4 _Software.Type . _Software.Name CcpNMR _Software.Version 2.4.2 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51444 4 'data analysis' . 51444 4 'peak picking' . 51444 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51444 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '900 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51444 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-13C HMQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51444 1 2 '2D 1H-13C HMQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51444 1 3 '2D 1H-13C HMQC' no no no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51444 1 4 '2D 1H-13C HMQC' no no no . . . . . . . . . . 5 $sample_5 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51444 1 5 '2D 1H-13C SOFAST-HMQC' no no no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51444 1 6 '2D 1H-13C SOFAST-HMQC' no no no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51444 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51444 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 51444 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 51444 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51444 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'FhaC nanodisc shifts' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-13C HMQC' . . . 51444 1 3 '2D 1H-13C HMQC' . . . 51444 1 4 '2D 1H-13C HMQC' . . . 51444 1 5 '2D 1H-13C SOFAST-HMQC' . . . 51444 1 6 '2D 1H-13C SOFAST-HMQC' . . . 51444 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $software_3 . . 51444 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 14 14 ILE HD11 H 1 0.711 0.020 . 1 . . . . . 14 ILE MD . 51444 1 2 . 1 . 1 14 14 ILE HD12 H 1 0.711 0.020 . 1 . . . . . 14 ILE MD . 51444 1 3 . 1 . 1 14 14 ILE HD13 H 1 0.711 0.020 . 1 . . . . . 14 ILE MD . 51444 1 4 . 1 . 1 14 14 ILE CD1 C 13 15.59 0.100 . 1 . . . . . 14 ILE CD1 . 51444 1 5 . 1 . 1 27 27 ILE HD11 H 1 0.296 0.020 . 1 . . . . . 27 ILE MD . 51444 1 6 . 1 . 1 27 27 ILE HD12 H 1 0.296 0.020 . 1 . . . . . 27 ILE MD . 51444 1 7 . 1 . 1 27 27 ILE HD13 H 1 0.296 0.020 . 1 . . . . . 27 ILE MD . 51444 1 8 . 1 . 1 27 27 ILE CD1 C 13 12.92 0.100 . 1 . . . . . 27 ILE CD1 . 51444 1 9 . 1 . 1 114 114 ILE HD11 H 1 0.711 0.020 . 1 . . . . . 114 ILE MD . 51444 1 10 . 1 . 1 114 114 ILE HD12 H 1 0.711 0.020 . 1 . . . . . 114 ILE MD . 51444 1 11 . 1 . 1 114 114 ILE HD13 H 1 0.711 0.020 . 1 . . . . . 114 ILE MD . 51444 1 12 . 1 . 1 114 114 ILE CD1 C 13 13.72 0.100 . 1 . . . . . 114 ILE CD1 . 51444 1 13 . 1 . 1 136 136 ILE HD11 H 1 0.884 0.020 . 1 . . . . . 136 ILE MD . 51444 1 14 . 1 . 1 136 136 ILE HD12 H 1 0.884 0.020 . 1 . . . . . 136 ILE MD . 51444 1 15 . 1 . 1 136 136 ILE HD13 H 1 0.884 0.020 . 1 . . . . . 136 ILE MD . 51444 1 16 . 1 . 1 136 136 ILE CD1 C 13 14.95 0.100 . 1 . . . . . 136 ILE CD1 . 51444 1 17 . 1 . 1 141 141 ILE HD11 H 1 0.584 0.020 . 1 . . . . . 141 ILE MD . 51444 1 18 . 1 . 1 141 141 ILE HD12 H 1 0.584 0.020 . 1 . . . . . 141 ILE MD . 51444 1 19 . 1 . 1 141 141 ILE HD13 H 1 0.584 0.020 . 1 . . . . . 141 ILE MD . 51444 1 20 . 1 . 1 141 141 ILE CD1 C 13 11.71 0.100 . 1 . . . . . 141 ILE CD1 . 51444 1 21 . 1 . 1 172 172 ILE HD11 H 1 0.605 0.020 . 1 . . . . . 172 ILE MD . 51444 1 22 . 1 . 1 172 172 ILE HD12 H 1 0.605 0.020 . 1 . . . . . 172 ILE MD . 51444 1 23 . 1 . 1 172 172 ILE HD13 H 1 0.605 0.020 . 1 . . . . . 172 ILE MD . 51444 1 24 . 1 . 1 172 172 ILE CD1 C 13 13.47 0.100 . 1 . . . . . 172 ILE CD1 . 51444 1 25 . 1 . 1 176 176 ILE HD11 H 1 0.784 0.020 . 1 . . . . . 176 ILE MD . 51444 1 26 . 1 . 1 176 176 ILE HD12 H 1 0.784 0.020 . 1 . . . . . 176 ILE MD . 51444 1 27 . 1 . 1 176 176 ILE HD13 H 1 0.784 0.020 . 1 . . . . . 176 ILE MD . 51444 1 28 . 1 . 1 176 176 ILE CD1 C 13 12.60 0.100 . 1 . . . . . 176 ILE CD1 . 51444 1 29 . 1 . 1 179 179 ILE HD11 H 1 0.556 0.020 . 1 . . . . . 179 ILE MD . 51444 1 30 . 1 . 1 179 179 ILE HD12 H 1 0.556 0.020 . 1 . . . . . 179 ILE MD . 51444 1 31 . 1 . 1 179 179 ILE HD13 H 1 0.556 0.020 . 1 . . . . . 179 ILE MD . 51444 1 32 . 1 . 1 179 179 ILE CD1 C 13 13.57 0.100 . 1 . . . . . 179 ILE CD1 . 51444 1 33 . 1 . 1 188 188 ILE HD11 H 1 0.921 0.020 . 1 . . . . . 188 ILE MD . 51444 1 34 . 1 . 1 188 188 ILE HD12 H 1 0.921 0.020 . 1 . . . . . 188 ILE MD . 51444 1 35 . 1 . 1 188 188 ILE HD13 H 1 0.921 0.020 . 1 . . . . . 188 ILE MD . 51444 1 36 . 1 . 1 188 188 ILE CD1 C 13 14.68 0.100 . 1 . . . . . 188 ILE CD1 . 51444 1 37 . 1 . 1 190 190 ILE HD11 H 1 0.602 0.020 . 1 . . . . . 190 ILE MD . 51444 1 38 . 1 . 1 190 190 ILE HD12 H 1 0.602 0.020 . 1 . . . . . 190 ILE MD . 51444 1 39 . 1 . 1 190 190 ILE HD13 H 1 0.602 0.020 . 1 . . . . . 190 ILE MD . 51444 1 40 . 1 . 1 190 190 ILE CD1 C 13 13.61 0.100 . 1 . . . . . 190 ILE CD1 . 51444 1 41 . 1 . 1 252 252 ILE HD11 H 1 0.890 0.020 . 1 . . . . . 252 ILE MD . 51444 1 42 . 1 . 1 252 252 ILE HD12 H 1 0.890 0.020 . 1 . . . . . 252 ILE MD . 51444 1 43 . 1 . 1 252 252 ILE HD13 H 1 0.890 0.020 . 1 . . . . . 252 ILE MD . 51444 1 44 . 1 . 1 252 252 ILE CD1 C 13 14.80 0.100 . 1 . . . . . 252 ILE CD1 . 51444 1 45 . 1 . 1 420 420 ILE HD11 H 1 0.802 0.020 . 1 . . . . . 420 ILE MD . 51444 1 46 . 1 . 1 420 420 ILE HD12 H 1 0.802 0.020 . 1 . . . . . 420 ILE MD . 51444 1 47 . 1 . 1 420 420 ILE HD13 H 1 0.802 0.020 . 1 . . . . . 420 ILE MD . 51444 1 48 . 1 . 1 420 420 ILE CD1 C 13 14.60 0.100 . 1 . . . . . 420 ILE CD1 . 51444 1 49 . 1 . 1 441 441 ILE HD11 H 1 0.623 0.020 . 1 . . . . . 441 ILE MD . 51444 1 50 . 1 . 1 441 441 ILE HD12 H 1 0.623 0.020 . 1 . . . . . 441 ILE MD . 51444 1 51 . 1 . 1 441 441 ILE HD13 H 1 0.623 0.020 . 1 . . . . . 441 ILE MD . 51444 1 52 . 1 . 1 441 441 ILE CD1 C 13 12.47 0.100 . 1 . . . . . 441 ILE CD1 . 51444 1 53 . 1 . 1 506 506 ILE HD11 H 1 0.791 0.020 . 1 . . . . . 506 ILE MD . 51444 1 54 . 1 . 1 506 506 ILE HD12 H 1 0.791 0.020 . 1 . . . . . 506 ILE MD . 51444 1 55 . 1 . 1 506 506 ILE HD13 H 1 0.791 0.020 . 1 . . . . . 506 ILE MD . 51444 1 56 . 1 . 1 506 506 ILE CD1 C 13 12.93 0.100 . 1 . . . . . 506 ILE CD1 . 51444 1 57 . 1 . 1 548 548 ILE HD11 H 1 0.854 0.020 . 1 . . . . . 548 ILE MD . 51444 1 58 . 1 . 1 548 548 ILE HD12 H 1 0.854 0.020 . 1 . . . . . 548 ILE MD . 51444 1 59 . 1 . 1 548 548 ILE HD13 H 1 0.854 0.020 . 1 . . . . . 548 ILE MD . 51444 1 60 . 1 . 1 548 548 ILE CD1 C 13 14.20 0.100 . 1 . . . . . 548 ILE CD1 . 51444 1 stop_ save_