data_50401 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50401 _Entry.Title ; hFOXO4_240_280 backbone assignment ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-07-22 _Entry.Accession_date 2020-07-22 _Entry.Last_release_date 2020-07-22 _Entry.Original_release_date 2020-07-22 _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 Benjamin Bourgeois . . . . 50401 2 Tobias Madl . . . . 50401 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50401 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 16 50401 '15N chemical shifts' 36 50401 '1H chemical shifts' 37 50401 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 1 . . 2021-08-11 . original BMRB . 50401 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 50398 'human FOXO4 86_207' 50401 BMRB 50402 'human hFOXO4 465-500' 50401 BMRB 50403 'human hFOXO4 FHCR3' 50401 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50401 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 34320339 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Multiple regulatory intrinsically disordered motifs control FOXO4 transcription factor binding and function ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Cell Rep.' _Citation.Journal_name_full 'Cell reports' _Citation.Journal_volume 36 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2211-1247 _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 109446 _Citation.Page_last 109446 _Citation.Year 2021 _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 Benjamin Bourgeois B. . . . 50401 1 2 Tianshu Gui T. . . . 50401 1 3 Diana Hoogeboom D. . . . 50401 1 4 Henry Hocking H. G. . . 50401 1 5 Gesa Richter G. . . . 50401 1 6 Emil Spreitzer E. . . . 50401 1 7 Martin Viertler M. . . . 50401 1 8 Klaus Richter K. . . . 50401 1 9 Tobias Madl T. . . . 50401 1 10 Boudewijn Burgering . . . . 50401 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50401 _Assembly.ID 1 _Assembly.Name 'human hFOXO4 240_280' _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 no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 'human hFOXO4 240_280' 1 $entity_1 . . yes native no no . . . 50401 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50401 _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 ; GSPCSRNREEADMWTTFRPR SSSNASSVSTRLSPLRPESE V ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _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 41 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 1 240 GLY . 50401 1 2 241 SER . 50401 1 3 242 PRO . 50401 1 4 243 CYS . 50401 1 5 244 SER . 50401 1 6 245 ARG . 50401 1 7 246 ASN . 50401 1 8 247 ARG . 50401 1 9 248 GLU . 50401 1 10 249 GLU . 50401 1 11 250 ALA . 50401 1 12 251 ASP . 50401 1 13 252 MET . 50401 1 14 253 TRP . 50401 1 15 254 THR . 50401 1 16 255 THR . 50401 1 17 256 PHE . 50401 1 18 257 ARG . 50401 1 19 258 PRO . 50401 1 20 259 ARG . 50401 1 21 260 SER . 50401 1 22 261 SER . 50401 1 23 262 SER . 50401 1 24 263 ASN . 50401 1 25 264 ALA . 50401 1 26 265 SER . 50401 1 27 266 SER . 50401 1 28 267 VAL . 50401 1 29 268 SER . 50401 1 30 269 THR . 50401 1 31 270 ARG . 50401 1 32 271 LEU . 50401 1 33 272 SER . 50401 1 34 273 PRO . 50401 1 35 274 LEU . 50401 1 36 275 ARG . 50401 1 37 276 PRO . 50401 1 38 277 GLU . 50401 1 39 278 SER . 50401 1 40 279 GLU . 50401 1 41 280 VAL . 50401 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 . GLY 1 1 50401 1 . SER 2 2 50401 1 . PRO 3 3 50401 1 . CYS 4 4 50401 1 . SER 5 5 50401 1 . ARG 6 6 50401 1 . ASN 7 7 50401 1 . ARG 8 8 50401 1 . GLU 9 9 50401 1 . GLU 10 10 50401 1 . ALA 11 11 50401 1 . ASP 12 12 50401 1 . MET 13 13 50401 1 . TRP 14 14 50401 1 . THR 15 15 50401 1 . THR 16 16 50401 1 . PHE 17 17 50401 1 . ARG 18 18 50401 1 . PRO 19 19 50401 1 . ARG 20 20 50401 1 . SER 21 21 50401 1 . SER 22 22 50401 1 . SER 23 23 50401 1 . ASN 24 24 50401 1 . ALA 25 25 50401 1 . SER 26 26 50401 1 . SER 27 27 50401 1 . VAL 28 28 50401 1 . SER 29 29 50401 1 . THR 30 30 50401 1 . ARG 31 31 50401 1 . LEU 32 32 50401 1 . SER 33 33 50401 1 . PRO 34 34 50401 1 . LEU 35 35 50401 1 . ARG 36 36 50401 1 . PRO 37 37 50401 1 . GLU 38 38 50401 1 . SER 39 39 50401 1 . GLU 40 40 50401 1 . VAL 41 41 50401 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 50401 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 50401 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 50401 _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 . . . plasmid . . pETZ1a . . . 50401 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50401 _Sample.ID 1 _Sample.Name hFOXO4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% 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 FOXO4_240-280 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 500 . . uM . . . . 50401 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 50401 1 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 50401 1 4 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 50401 1 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 50401 _Sample_condition_list.ID 1 _Sample_condition_list.Name condition _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' 0.15 . M 50401 1 pH 6.5 . pH 50401 1 pressure 1 . atm 50401 1 temperature 298 . K 50401 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50401 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50401 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50401 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 50401 2 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 50401 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name bruker _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 50401 _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-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50401 1 2 '3D CBCACONH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50401 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50401 1 4 '3D HN(CA)NNH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50401 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 50401 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name CS _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 water protons . . . . ppm 4.7 internal indirect . . . . . . 50401 1 H 1 water protons . . . . ppm 4.7 internal direct 1 . . . . . 50401 1 N 15 water protons . . . . ppm 4.7 internal indirect . . . . . . 50401 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 50401 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name shift_list _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 . _Assigned_chem_shift_list.Chem_shift_13C_err . _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-15N HSQC' . . . 50401 1 2 '3D CBCACONH' . . . 50401 1 3 '3D HNCACB' . . . 50401 1 4 '3D HN(CA)NNH' . . . 50401 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 1 $software_1 . . 50401 1 2 $software_2 . . 50401 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 2 2 SER H H 1 8.139 0.001 . . . . . . . 241 SER HN . 50401 1 2 . 1 . 1 2 2 SER N N 15 116.776 0.027 . . . . . . . 241 SER N . 50401 1 3 . 1 . 1 4 4 CYS H H 1 8.343 0.002 . . . . . . . 243 CYS HN . 50401 1 4 . 1 . 1 4 4 CYS N N 15 118.884 0.019 . . . . . . . 243 CYS N . 50401 1 5 . 1 . 1 5 5 SER H H 1 8.284 0.002 . . . . . . . 244 SER HN . 50401 1 6 . 1 . 1 5 5 SER N N 15 118.365 0.018 . . . . . . . 244 SER N . 50401 1 7 . 1 . 1 6 6 ARG H H 1 8.289 0.005 . . . . . . . 245 ARG HN . 50401 1 8 . 1 . 1 6 6 ARG N N 15 122.754 0.057 . . . . . . . 245 ARG N . 50401 1 9 . 1 . 1 7 7 ASN H H 1 8.371 0.002 . . . . . . . 246 ASN HN . 50401 1 10 . 1 . 1 7 7 ASN N N 15 119.709 0.013 . . . . . . . 246 ASN N . 50401 1 11 . 1 . 1 8 8 ARG H H 1 8.285 0.001 . . . . . . . 247 ARG HN . 50401 1 12 . 1 . 1 8 8 ARG N N 15 121.590 0.011 . . . . . . . 247 ARG N . 50401 1 13 . 1 . 1 9 9 GLU H H 1 8.423 0.002 . . . . . . . 248 GLU HN . 50401 1 14 . 1 . 1 9 9 GLU CA C 13 56.935 0.000 . . . . . . . 248 GLU CA . 50401 1 15 . 1 . 1 9 9 GLU CB C 13 29.967 0.000 . . . . . . . 248 GLU CB . 50401 1 16 . 1 . 1 9 9 GLU N N 15 121.315 0.027 . . . . . . . 248 GLU N . 50401 1 17 . 1 . 1 10 10 GLU H H 1 8.239 0.001 . . . . . . . 249 GLU HN . 50401 1 18 . 1 . 1 10 10 GLU CA C 13 56.929 0.055 . . . . . . . 249 GLU CA . 50401 1 19 . 1 . 1 10 10 GLU CB C 13 30.104 0.024 . . . . . . . 249 GLU CB . 50401 1 20 . 1 . 1 10 10 GLU N N 15 121.264 0.017 . . . . . . . 249 GLU N . 50401 1 21 . 1 . 1 11 11 ALA H H 1 8.120 0.003 . . . . . . . 250 ALA HN . 50401 1 22 . 1 . 1 11 11 ALA CA C 13 53.103 0.023 . . . . . . . 250 ALA CA . 50401 1 23 . 1 . 1 11 11 ALA CB C 13 19.165 0.008 . . . . . . . 250 ALA CB . 50401 1 24 . 1 . 1 11 11 ALA N N 15 123.617 0.003 . . . . . . . 250 ALA N . 50401 1 25 . 1 . 1 12 12 ASP H H 1 8.112 0.001 . . . . . . . 251 ASP HN . 50401 1 26 . 1 . 1 12 12 ASP CA C 13 54.619 0.000 . . . . . . . 251 ASP CA . 50401 1 27 . 1 . 1 12 12 ASP CB C 13 41.049 0.000 . . . . . . . 251 ASP CB . 50401 1 28 . 1 . 1 12 12 ASP N N 15 118.521 0.009 . . . . . . . 251 ASP N . 50401 1 29 . 1 . 1 13 13 MET H H 1 7.943 0.001 . . . . . . . 252 MET HN . 50401 1 30 . 1 . 1 13 13 MET N N 15 119.737 0.012 . . . . . . . 252 MET N . 50401 1 31 . 1 . 1 14 14 TRP H H 1 7.978 0.002 . . . . . . . 253 TRP HN . 50401 1 32 . 1 . 1 14 14 TRP HE1 H 1 10.060 0.000 . . . . . . . 253 TRP HE1 . 50401 1 33 . 1 . 1 14 14 TRP N N 15 120.420 0.011 . . . . . . . 253 TRP N . 50401 1 34 . 1 . 1 15 15 THR H H 1 7.805 0.002 . . . . . . . 254 THR HN . 50401 1 35 . 1 . 1 15 15 THR N N 15 114.074 0.004 . . . . . . . 254 THR N . 50401 1 36 . 1 . 1 16 16 THR H H 1 7.869 0.003 . . . . . . . 255 THR HN . 50401 1 37 . 1 . 1 16 16 THR N N 15 115.142 0.003 . . . . . . . 255 THR N . 50401 1 38 . 1 . 1 17 17 PHE H H 1 8.008 0.001 . . . . . . . 256 PHE HN . 50401 1 39 . 1 . 1 17 17 PHE N N 15 122.316 0.003 . . . . . . . 256 PHE N . 50401 1 40 . 1 . 1 18 18 ARG H H 1 7.899 0.000 . . . . . . . 257 ARG HN . 50401 1 41 . 1 . 1 18 18 ARG N N 15 124.395 0.007 . . . . . . . 257 ARG N . 50401 1 42 . 1 . 1 20 20 ARG H H 1 8.425 0.000 . . . . . . . 259 ARG HN . 50401 1 43 . 1 . 1 20 20 ARG N N 15 121.434 0.013 . . . . . . . 259 ARG N . 50401 1 44 . 1 . 1 21 21 SER H H 1 8.278 0.002 . . . . . . . 260 SER HN . 50401 1 45 . 1 . 1 21 21 SER N N 15 116.752 0.019 . . . . . . . 260 SER N . 50401 1 46 . 1 . 1 22 22 SER H H 1 8.339 0.000 . . . . . . . 261 SER HN . 50401 1 47 . 1 . 1 22 22 SER N N 15 117.726 0.022 . . . . . . . 261 SER N . 50401 1 48 . 1 . 1 23 23 SER H H 1 8.283 0.002 . . . . . . . 262 SER HN . 50401 1 49 . 1 . 1 23 23 SER N N 15 117.416 0.007 . . . . . . . 262 SER N . 50401 1 50 . 1 . 1 24 24 ASN H H 1 8.327 0.001 . . . . . . . 263 ASN HN . 50401 1 51 . 1 . 1 24 24 ASN N N 15 120.686 0.035 . . . . . . . 263 ASN N . 50401 1 52 . 1 . 1 25 25 ALA H H 1 8.182 0.001 . . . . . . . 264 ALA HN . 50401 1 53 . 1 . 1 25 25 ALA N N 15 124.310 0.016 . . . . . . . 264 ALA N . 50401 1 54 . 1 . 1 26 26 SER H H 1 8.213 0.002 . . . . . . . 265 SER HN . 50401 1 55 . 1 . 1 26 26 SER N N 15 114.610 0.015 . . . . . . . 265 SER N . 50401 1 56 . 1 . 1 27 27 SER H H 1 8.207 0.004 . . . . . . . 266 SER HN . 50401 1 57 . 1 . 1 27 27 SER CA C 13 58.264 0.000 . . . . . . . 266 SER CA . 50401 1 58 . 1 . 1 27 27 SER CB C 13 63.721 0.000 . . . . . . . 266 SER CB . 50401 1 59 . 1 . 1 27 27 SER N N 15 117.670 0.037 . . . . . . . 266 SER N . 50401 1 60 . 1 . 1 28 28 VAL H H 1 8.011 0.003 . . . . . . . 267 VAL HN . 50401 1 61 . 1 . 1 28 28 VAL CA C 13 62.481 0.000 . . . . . . . 267 VAL CA . 50401 1 62 . 1 . 1 28 28 VAL CB C 13 32.580 0.000 . . . . . . . 267 VAL CB . 50401 1 63 . 1 . 1 28 28 VAL N N 15 121.066 0.008 . . . . . . . 267 VAL N . 50401 1 64 . 1 . 1 29 29 SER H H 1 8.279 0.001 . . . . . . . 268 SER HN . 50401 1 65 . 1 . 1 29 29 SER N N 15 118.833 0.005 . . . . . . . 268 SER N . 50401 1 66 . 1 . 1 30 30 THR H H 1 8.064 0.002 . . . . . . . 269 THR HN . 50401 1 67 . 1 . 1 30 30 THR N N 15 116.132 0.008 . . . . . . . 269 THR N . 50401 1 68 . 1 . 1 31 31 ARG H H 1 8.155 0.000 . . . . . . . 270 ARG HN . 50401 1 69 . 1 . 1 31 31 ARG N N 15 123.162 0.006 . . . . . . . 270 ARG N . 50401 1 70 . 1 . 1 32 32 LEU H H 1 8.193 0.001 . . . . . . . 271 LEU HN . 50401 1 71 . 1 . 1 32 32 LEU CA C 13 54.990 0.034 . . . . . . . 271 LEU CA . 50401 1 72 . 1 . 1 32 32 LEU CB C 13 42.326 0.007 . . . . . . . 271 LEU CB . 50401 1 73 . 1 . 1 32 32 LEU N N 15 123.407 0.012 . . . . . . . 271 LEU N . 50401 1 74 . 1 . 1 33 33 SER H H 1 8.152 0.002 . . . . . . . 272 SER HN . 50401 1 75 . 1 . 1 33 33 SER CA C 13 56.193 0.000 . . . . . . . 272 SER CA . 50401 1 76 . 1 . 1 33 33 SER CB C 13 63.465 0.000 . . . . . . . 272 SER CB . 50401 1 77 . 1 . 1 33 33 SER N N 15 117.623 0.021 . . . . . . . 272 SER N . 50401 1 78 . 1 . 1 35 35 LEU H H 1 8.155 0.001 . . . . . . . 274 LEU HN . 50401 1 79 . 1 . 1 35 35 LEU N N 15 121.836 0.005 . . . . . . . 274 LEU N . 50401 1 80 . 1 . 1 36 36 ARG H H 1 8.157 0.000 . . . . . . . 275 ARG HN . 50401 1 81 . 1 . 1 36 36 ARG N N 15 122.526 0.002 . . . . . . . 275 ARG N . 50401 1 82 . 1 . 1 38 38 GLU H H 1 8.631 0.001 . . . . . . . 277 GLU HN . 50401 1 83 . 1 . 1 38 38 GLU N N 15 120.722 0.011 . . . . . . . 277 GLU N . 50401 1 84 . 1 . 1 39 39 SER H H 1 8.064 0.000 . . . . . . . 278 SER HN . 50401 1 85 . 1 . 1 39 39 SER N N 15 115.001 0.003 . . . . . . . 278 SER N . 50401 1 86 . 1 . 1 40 40 GLU H H 1 8.278 0.002 . . . . . . . 279 GLU HN . 50401 1 87 . 1 . 1 40 40 GLU N N 15 123.356 0.003 . . . . . . . 279 GLU N . 50401 1 88 . 1 . 1 41 41 VAL H H 1 7.598 0.002 . . . . . . . 280 VAL HN . 50401 1 89 . 1 . 1 41 41 VAL N N 15 124.272 0.002 . . . . . . . 280 VAL N . 50401 1 stop_ save_