data_50259 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50259 _Entry.Title ; 1H, 13C and 15N Resonance Assignments of the Transactivation domain of the Human Forkhead Transcription Factor FOXO4 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-05-04 _Entry.Accession_date 2020-05-04 _Entry.Last_release_date 2020-05-04 _Entry.Original_release_date 2020-05-04 _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 1 _Entry.Generated_software_label $software_1 _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 Chin-Ju Park . . . . 50259 2 Dabin Ahn . . . . 50259 3 Jinwoo Kim . . . . 50259 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50259 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 100 50259 '15N chemical shifts' 34 50259 '1H chemical shifts' 34 50259 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 . . 2021-08-17 . original BMRB . 50259 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50259 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33450250 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; FOXO4 Transactivation Domain Interaction with Forkhead DNA Binding Domain and Effect on Selective DNA Recognition for Transcription Initiation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 433 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1089-8638 _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 166808 _Citation.Page_last 166808 _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 Jinwoo Kim . . . . 50259 1 2 Dabin Ahn . . . . 50259 1 3 Chin-Ju Park . . . . 50259 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50259 _Assembly.ID 1 _Assembly.Name 'FOXO4 TAD' _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 'FOXO4 TAD' 1 $entity_1 . . yes native no no . . . 50259 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50259 _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 ; DLDLDMYMENLECDMDNIIS DLMDEGEGLDFNFEPDP ; _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 37 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state unknown _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 1 469 ASP . 50259 1 2 470 LEU . 50259 1 3 471 ASP . 50259 1 4 472 LEU . 50259 1 5 473 ASP . 50259 1 6 474 MET . 50259 1 7 475 TYR . 50259 1 8 476 MET . 50259 1 9 477 GLU . 50259 1 10 478 ASN . 50259 1 11 479 LEU . 50259 1 12 480 GLU . 50259 1 13 481 CYS . 50259 1 14 482 ASP . 50259 1 15 483 MET . 50259 1 16 484 ASP . 50259 1 17 485 ASN . 50259 1 18 486 ILE . 50259 1 19 487 ILE . 50259 1 20 488 SER . 50259 1 21 489 ASP . 50259 1 22 490 LEU . 50259 1 23 491 MET . 50259 1 24 492 ASP . 50259 1 25 493 GLU . 50259 1 26 494 GLY . 50259 1 27 495 GLU . 50259 1 28 496 GLY . 50259 1 29 497 LEU . 50259 1 30 498 ASP . 50259 1 31 499 PHE . 50259 1 32 500 ASN . 50259 1 33 501 PHE . 50259 1 34 502 GLU . 50259 1 35 503 PRO . 50259 1 36 504 ASP . 50259 1 37 505 PRO . 50259 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 . ASP 1 1 50259 1 . LEU 2 2 50259 1 . ASP 3 3 50259 1 . LEU 4 4 50259 1 . ASP 5 5 50259 1 . MET 6 6 50259 1 . TYR 7 7 50259 1 . MET 8 8 50259 1 . GLU 9 9 50259 1 . ASN 10 10 50259 1 . LEU 11 11 50259 1 . GLU 12 12 50259 1 . CYS 13 13 50259 1 . ASP 14 14 50259 1 . MET 15 15 50259 1 . ASP 16 16 50259 1 . ASN 17 17 50259 1 . ILE 18 18 50259 1 . ILE 19 19 50259 1 . SER 20 20 50259 1 . ASP 21 21 50259 1 . LEU 22 22 50259 1 . MET 23 23 50259 1 . ASP 24 24 50259 1 . GLU 25 25 50259 1 . GLY 26 26 50259 1 . GLU 27 27 50259 1 . GLY 28 28 50259 1 . LEU 29 29 50259 1 . ASP 30 30 50259 1 . PHE 31 31 50259 1 . ASN 32 32 50259 1 . PHE 33 33 50259 1 . GLU 34 34 50259 1 . PRO 35 35 50259 1 . ASP 36 36 50259 1 . PRO 37 37 50259 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 50259 _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 . . . . . . . . . . . . . 50259 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 50259 _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 . . 'pET His6 GST TEV LIC cloning vector (2G-T)' . . . 50259 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50259 _Sample.ID 1 _Sample.Name '13C 15N sample' _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 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 50259 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 50259 1 3 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 50259 1 4 'FOXO4 TAD' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 800 . . uM . . . . 50259 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 50259 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'room temp conditions' _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 pH 7.0 . pH 50259 1 pressure 1 . atm 50259 1 temperature 298 . K 50259 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50259 _Software.ID 1 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50259 1 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 50259 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '900MHz Cryogenic NMR spectrometer AVANCE 2' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 50259 _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 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50259 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50259 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50259 1 4 '3D HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50259 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 50259 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name '1H, 13C, 15N' _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 . . . . . 50259 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 50259 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 50259 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 50259 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'FOXO4 TAD' _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 '3D CBCA(CO)NH' . . . 50259 1 2 '3D HNCO' . . . 50259 1 3 '3D HNCACB' . . . 50259 1 4 '3D HN(CA)CO' . . . 50259 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 . . 50259 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 1 1 ASP H H 1 8.101 0.00 . . . . . . . 469 ASP H . 50259 1 2 . 1 . 1 1 1 ASP C C 13 173.486 0.00 . . . . . . . 469 ASP CO . 50259 1 3 . 1 . 1 1 1 ASP CA C 13 51.962 0.08 . . . . . . . 469 ASP CA . 50259 1 4 . 1 . 1 1 1 ASP CB C 13 38.205 0.02 . . . . . . . 469 ASP CB . 50259 1 5 . 1 . 1 1 1 ASP N N 15 118.749 0.00 . . . . . . . 469 ASP N . 50259 1 6 . 1 . 1 2 2 LEU H H 1 7.887 0.00 . . . . . . . 470 LEU H . 50259 1 7 . 1 . 1 2 2 LEU C C 13 174.302 0.00 . . . . . . . 470 LEU CO . 50259 1 8 . 1 . 1 2 2 LEU CA C 13 52.617 0.14 . . . . . . . 470 LEU CA . 50259 1 9 . 1 . 1 2 2 LEU CB C 13 40.543 1.21 . . . . . . . 470 LEU CB . 50259 1 10 . 1 . 1 2 2 LEU N N 15 121.411 0.00 . . . . . . . 470 LEU N . 50259 1 11 . 1 . 1 3 3 ASP H H 1 8.190 0.00 . . . . . . . 471 ASP H . 50259 1 12 . 1 . 1 3 3 ASP C C 13 173.607 0.00 . . . . . . . 471 ASP CO . 50259 1 13 . 1 . 1 3 3 ASP CA C 13 51.727 0.12 . . . . . . . 471 ASP CA . 50259 1 14 . 1 . 1 3 3 ASP CB C 13 38.151 0.02 . . . . . . . 471 ASP CB . 50259 1 15 . 1 . 1 3 3 ASP N N 15 120.921 0.01 . . . . . . . 471 ASP N . 50259 1 16 . 1 . 1 4 4 LEU H H 1 7.979 0.00 . . . . . . . 472 LEU H . 50259 1 17 . 1 . 1 4 4 LEU C C 13 174.762 0.00 . . . . . . . 472 LEU CO . 50259 1 18 . 1 . 1 4 4 LEU CA C 13 52.972 0.10 . . . . . . . 472 LEU CA . 50259 1 19 . 1 . 1 4 4 LEU CB C 13 39.663 0.05 . . . . . . . 472 LEU CB . 50259 1 20 . 1 . 1 4 4 LEU N N 15 122.234 0.03 . . . . . . . 472 LEU N . 50259 1 21 . 1 . 1 5 5 ASP H H 1 8.236 0.00 . . . . . . . 473 ASP H . 50259 1 22 . 1 . 1 5 5 ASP C C 13 173.839 0.00 . . . . . . . 473 ASP CO . 50259 1 23 . 1 . 1 5 5 ASP CA C 13 52.227 0.11 . . . . . . . 473 ASP CA . 50259 1 24 . 1 . 1 5 5 ASP CB C 13 38.156 0.02 . . . . . . . 473 ASP CB . 50259 1 25 . 1 . 1 5 5 ASP N N 15 120.406 0.01 . . . . . . . 473 ASP N . 50259 1 26 . 1 . 1 6 6 MET H H 1 7.962 0.00 . . . . . . . 474 MET H . 50259 1 27 . 1 . 1 6 6 MET C C 13 173.333 0.00 . . . . . . . 474 MET CO . 50259 1 28 . 1 . 1 6 6 MET CA C 13 53.222 0.05 . . . . . . . 474 MET CA . 50259 1 29 . 1 . 1 6 6 MET CB C 13 29.957 0.03 . . . . . . . 474 MET CB . 50259 1 30 . 1 . 1 6 6 MET N N 15 119.699 0.00 . . . . . . . 474 MET N . 50259 1 31 . 1 . 1 7 7 TYR H H 1 8.077 0.00 . . . . . . . 475 TYR H . 50259 1 32 . 1 . 1 7 7 TYR C C 13 173.068 0.01 . . . . . . . 475 TYR CO . 50259 1 33 . 1 . 1 7 7 TYR CA C 13 55.645 0.03 . . . . . . . 475 TYR CA . 50259 1 34 . 1 . 1 7 7 TYR CB C 13 35.662 0.01 . . . . . . . 475 TYR CB . 50259 1 35 . 1 . 1 7 7 TYR N N 15 120.941 0.00 . . . . . . . 475 TYR N . 50259 1 36 . 1 . 1 8 8 MET H H 1 7.945 0.00 . . . . . . . 476 MET H . 50259 1 37 . 1 . 1 8 8 MET C C 13 173.119 0.00 . . . . . . . 476 MET CO . 50259 1 38 . 1 . 1 8 8 MET CA C 13 52.659 0.03 . . . . . . . 476 MET CA . 50259 1 39 . 1 . 1 8 8 MET CB C 13 30.275 0.04 . . . . . . . 476 MET CB . 50259 1 40 . 1 . 1 8 8 MET N N 15 121.933 0.03 . . . . . . . 476 MET N . 50259 1 41 . 1 . 1 9 9 GLU H H 1 8.195 0.00 . . . . . . . 477 GLU H . 50259 1 42 . 1 . 1 9 9 GLU C C 13 173.312 0.00 . . . . . . . 477 GLU CO . 50259 1 43 . 1 . 1 9 9 GLU CA C 13 54.107 0.02 . . . . . . . 477 GLU CA . 50259 1 44 . 1 . 1 9 9 GLU CB C 13 27.649 0.01 . . . . . . . 477 GLU CB . 50259 1 45 . 1 . 1 9 9 GLU N N 15 121.722 0.03 . . . . . . . 477 GLU N . 50259 1 46 . 1 . 1 10 10 ASN H H 1 8.337 0.00 . . . . . . . 478 ASN H . 50259 1 47 . 1 . 1 10 10 ASN C C 13 172.271 0.00 . . . . . . . 478 ASN CO . 50259 1 48 . 1 . 1 10 10 ASN CA C 13 50.499 0.02 . . . . . . . 478 ASN CA . 50259 1 49 . 1 . 1 10 10 ASN CB C 13 36.136 0.02 . . . . . . . 478 ASN CB . 50259 1 50 . 1 . 1 10 10 ASN N N 15 119.394 0.00 . . . . . . . 478 ASN N . 50259 1 51 . 1 . 1 11 11 LEU H H 1 8.164 0.00 . . . . . . . 479 LEU H . 50259 1 52 . 1 . 1 11 11 LEU C C 13 174.799 0.00 . . . . . . . 479 LEU CO . 50259 1 53 . 1 . 1 11 11 LEU CA C 13 52.555 0.05 . . . . . . . 479 LEU CA . 50259 1 54 . 1 . 1 11 11 LEU CB C 13 39.663 0.02 . . . . . . . 479 LEU CB . 50259 1 55 . 1 . 1 11 11 LEU N N 15 122.926 0.00 . . . . . . . 479 LEU N . 50259 1 56 . 1 . 1 12 12 GLU H H 1 8.311 0.00 . . . . . . . 480 GLU H . 50259 1 57 . 1 . 1 12 12 GLU C C 13 173.633 0.00 . . . . . . . 480 GLU CO . 50259 1 58 . 1 . 1 12 12 GLU CA C 13 53.881 0.06 . . . . . . . 480 GLU CA . 50259 1 59 . 1 . 1 12 12 GLU CB C 13 27.301 0.01 . . . . . . . 480 GLU CB . 50259 1 60 . 1 . 1 12 12 GLU N N 15 121.385 0.00 . . . . . . . 480 GLU N . 50259 1 61 . 1 . 1 13 13 CYS H H 1 8.186 0.00 . . . . . . . 481 CYS H . 50259 1 62 . 1 . 1 13 13 CYS C C 13 171.360 0.00 . . . . . . . 481 CYS CO . 50259 1 63 . 1 . 1 13 13 CYS CA C 13 55.565 0.02 . . . . . . . 481 CYS CA . 50259 1 64 . 1 . 1 13 13 CYS CB C 13 25.678 0.02 . . . . . . . 481 CYS CB . 50259 1 65 . 1 . 1 13 13 CYS N N 15 119.694 0.00 . . . . . . . 481 CYS N . 50259 1 66 . 1 . 1 14 14 ASP H H 1 8.382 0.00 . . . . . . . 482 ASP H . 50259 1 67 . 1 . 1 14 14 ASP C C 13 173.692 0.00 . . . . . . . 482 ASP CO . 50259 1 68 . 1 . 1 14 14 ASP CA C 13 51.769 0.04 . . . . . . . 482 ASP CA . 50259 1 69 . 1 . 1 14 14 ASP CB C 13 38.278 0.02 . . . . . . . 482 ASP CB . 50259 1 70 . 1 . 1 14 14 ASP N N 15 123.189 0.00 . . . . . . . 482 ASP N . 50259 1 71 . 1 . 1 15 15 MET H H 1 8.243 0.00 . . . . . . . 483 MET H . 50259 1 72 . 1 . 1 15 15 MET C C 13 173.513 0.00 . . . . . . . 483 MET CO . 50259 1 73 . 1 . 1 15 15 MET CA C 13 52.982 0.02 . . . . . . . 483 MET CA . 50259 1 74 . 1 . 1 15 15 MET CB C 13 30.012 0.04 . . . . . . . 483 MET CB . 50259 1 75 . 1 . 1 15 15 MET N N 15 120.905 0.01 . . . . . . . 483 MET N . 50259 1 76 . 1 . 1 16 16 ASP H H 1 8.270 0.00 . . . . . . . 484 ASP H . 50259 1 77 . 1 . 1 16 16 ASP C C 13 173.307 0.00 . . . . . . . 484 ASP CO . 50259 1 78 . 1 . 1 16 16 ASP CA C 13 52.120 0.14 . . . . . . . 484 ASP CA . 50259 1 79 . 1 . 1 16 16 ASP CB C 13 38.365 0.02 . . . . . . . 484 ASP CB . 50259 1 80 . 1 . 1 16 16 ASP N N 15 120.655 0.02 . . . . . . . 484 ASP N . 50259 1 81 . 1 . 1 17 17 ASN H H 1 8.145 0.00 . . . . . . . 485 ASN H . 50259 1 82 . 1 . 1 17 17 ASN C C 13 172.072 0.00 . . . . . . . 485 ASN CO . 50259 1 83 . 1 . 1 17 17 ASN CA C 13 50.563 0.03 . . . . . . . 485 ASN CA . 50259 1 84 . 1 . 1 17 17 ASN CB C 13 36.278 0.06 . . . . . . . 485 ASN CB . 50259 1 85 . 1 . 1 17 17 ASN N N 15 118.536 0.01 . . . . . . . 485 ASN N . 50259 1 86 . 1 . 1 18 18 ILE H H 1 7.936 0.00 . . . . . . . 486 ILE H . 50259 1 87 . 1 . 1 18 18 ILE C C 13 173.533 0.01 . . . . . . . 486 ILE CO . 50259 1 88 . 1 . 1 18 18 ILE CA C 13 58.524 0.04 . . . . . . . 486 ILE CA . 50259 1 89 . 1 . 1 18 18 ILE CB C 13 35.784 0.09 . . . . . . . 486 ILE CB . 50259 1 90 . 1 . 1 18 18 ILE N N 15 121.268 0.00 . . . . . . . 486 ILE N . 50259 1 91 . 1 . 1 19 19 ILE H H 1 8.203 0.00 . . . . . . . 487 ILE H . 50259 1 92 . 1 . 1 19 19 ILE C C 13 173.516 0.00 . . . . . . . 487 ILE CO . 50259 1 93 . 1 . 1 19 19 ILE CA C 13 58.267 0.04 . . . . . . . 487 ILE CA . 50259 1 94 . 1 . 1 19 19 ILE CB C 13 35.719 0.09 . . . . . . . 487 ILE CB . 50259 1 95 . 1 . 1 19 19 ILE N N 15 125.712 0.01 . . . . . . . 487 ILE N . 50259 1 96 . 1 . 1 20 20 SER H H 1 8.298 0.00 . . . . . . . 488 SER H . 50259 1 97 . 1 . 1 20 20 SER C C 13 171.448 0.01 . . . . . . . 488 SER CO . 50259 1 98 . 1 . 1 20 20 SER CA C 13 55.613 0.03 . . . . . . . 488 SER CA . 50259 1 99 . 1 . 1 20 20 SER CB C 13 61.331 0.03 . . . . . . . 488 SER CB . 50259 1 100 . 1 . 1 20 20 SER N N 15 120.483 0.01 . . . . . . . 488 SER N . 50259 1 101 . 1 . 1 21 21 ASP H H 1 8.270 0.00 . . . . . . . 489 ASP H . 50259 1 102 . 1 . 1 21 21 ASP C C 13 173.310 0.00 . . . . . . . 489 ASP CO . 50259 1 103 . 1 . 1 21 21 ASP CA C 13 51.730 0.01 . . . . . . . 489 ASP CA . 50259 1 104 . 1 . 1 21 21 ASP CB C 13 38.375 0.02 . . . . . . . 489 ASP CB . 50259 1 105 . 1 . 1 21 21 ASP N N 15 122.789 0.01 . . . . . . . 489 ASP N . 50259 1 106 . 1 . 1 22 22 LEU H H 1 8.055 0.00 . . . . . . . 490 LEU H . 50259 1 107 . 1 . 1 22 22 LEU C C 13 174.646 0.00 . . . . . . . 490 LEU CO . 50259 1 108 . 1 . 1 22 22 LEU CA C 13 52.529 0.10 . . . . . . . 490 LEU CA . 50259 1 109 . 1 . 1 22 22 LEU CB C 13 39.468 0.05 . . . . . . . 490 LEU CB . 50259 1 110 . 1 . 1 22 22 LEU N N 15 121.892 0.00 . . . . . . . 490 LEU N . 50259 1 111 . 1 . 1 23 23 MET H H 1 8.264 0.00 . . . . . . . 491 MET H . 50259 1 112 . 1 . 1 23 23 MET C C 13 173.124 0.00 . . . . . . . 491 MET CO . 50259 1 113 . 1 . 1 23 23 MET CA C 13 52.657 0.04 . . . . . . . 491 MET CA . 50259 1 114 . 1 . 1 23 23 MET CB C 13 30.205 0.03 . . . . . . . 491 MET CB . 50259 1 115 . 1 . 1 23 23 MET N N 15 121.131 0.00 . . . . . . . 491 MET N . 50259 1 116 . 1 . 1 24 24 ASP H H 1 8.252 0.00 . . . . . . . 492 ASP H . 50259 1 117 . 1 . 1 24 24 ASP C C 13 173.603 0.00 . . . . . . . 492 ASP CO . 50259 1 118 . 1 . 1 24 24 ASP CA C 13 51.651 0.08 . . . . . . . 492 ASP CA . 50259 1 119 . 1 . 1 24 24 ASP CB C 13 38.682 0.02 . . . . . . . 492 ASP CB . 50259 1 120 . 1 . 1 24 24 ASP N N 15 121.918 0.00 . . . . . . . 492 ASP N . 50259 1 121 . 1 . 1 25 25 GLU H H 1 8.417 0.00 . . . . . . . 493 GLU H . 50259 1 122 . 1 . 1 25 25 GLU C C 13 174.378 0.00 . . . . . . . 493 GLU CO . 50259 1 123 . 1 . 1 25 25 GLU CA C 13 54.198 0.01 . . . . . . . 493 GLU CA . 50259 1 124 . 1 . 1 25 25 GLU CB C 13 27.515 0.01 . . . . . . . 493 GLU CB . 50259 1 125 . 1 . 1 25 25 GLU N N 15 122.028 0.00 . . . . . . . 493 GLU N . 50259 1 126 . 1 . 1 26 26 GLY H H 1 8.384 0.00 . . . . . . . 494 GLY H . 50259 1 127 . 1 . 1 26 26 GLY C C 13 171.530 0.00 . . . . . . . 494 GLY CO . 50259 1 128 . 1 . 1 26 26 GLY CA C 13 42.644 0.00 . . . . . . . 494 GLY CA . 50259 1 129 . 1 . 1 26 26 GLY N N 15 125.482 0.00 . . . . . . . 494 GLY N . 50259 1 130 . 1 . 1 27 27 GLU H H 1 8.225 0.00 . . . . . . . 495 GLU H . 50259 1 131 . 1 . 1 27 27 GLU C C 13 174.369 0.00 . . . . . . . 495 GLU CO . 50259 1 132 . 1 . 1 27 27 GLU CA C 13 53.942 0.04 . . . . . . . 495 GLU CA . 50259 1 133 . 1 . 1 27 27 GLU CB C 13 27.701 0.02 . . . . . . . 495 GLU CB . 50259 1 134 . 1 . 1 27 27 GLU N N 15 120.488 0.00 . . . . . . . 495 GLU N . 50259 1 135 . 1 . 1 28 28 GLY H H 1 8.420 0.00 . . . . . . . 496 GLY H . 50259 1 136 . 1 . 1 28 28 GLY C C 13 171.480 0.00 . . . . . . . 496 GLY CO . 50259 1 137 . 1 . 1 28 28 GLY CA C 13 42.733 0.00 . . . . . . . 496 GLY CA . 50259 1 138 . 1 . 1 28 28 GLY N N 15 125.765 0.00 . . . . . . . 496 GLY N . 50259 1 139 . 1 . 1 29 29 LEU H H 1 7.960 0.00 . . . . . . . 497 LEU H . 50259 1 140 . 1 . 1 29 29 LEU C C 13 174.217 0.00 . . . . . . . 497 LEU CO . 50259 1 141 . 1 . 1 29 29 LEU CA C 13 52.274 0.05 . . . . . . . 497 LEU CA . 50259 1 142 . 1 . 1 29 29 LEU CB C 13 39.692 0.05 . . . . . . . 497 LEU CB . 50259 1 143 . 1 . 1 29 29 LEU N N 15 121.212 0.01 . . . . . . . 497 LEU N . 50259 1 144 . 1 . 1 30 30 ASP H H 1 8.194 0.00 . . . . . . . 498 ASP H . 50259 1 145 . 1 . 1 30 30 ASP C C 13 173.051 0.00 . . . . . . . 498 ASP CO . 50259 1 146 . 1 . 1 30 30 ASP CA C 13 51.345 0.03 . . . . . . . 498 ASP CA . 50259 1 147 . 1 . 1 30 30 ASP CB C 13 38.432 0.03 . . . . . . . 498 ASP CB . 50259 1 148 . 1 . 1 30 30 ASP N N 15 120.525 0.01 . . . . . . . 498 ASP N . 50259 1 149 . 1 . 1 31 31 PHE H H 1 7.973 0.00 . . . . . . . 499 PHE H . 50259 1 150 . 1 . 1 31 31 PHE C C 13 172.405 0.00 . . . . . . . 499 PHE CO . 50259 1 151 . 1 . 1 31 31 PHE CA C 13 54.897 0.02 . . . . . . . 499 PHE CA . 50259 1 152 . 1 . 1 31 31 PHE CB C 13 36.831 0.05 . . . . . . . 499 PHE CB . 50259 1 153 . 1 . 1 31 31 PHE N N 15 120.652 0.01 . . . . . . . 499 PHE N . 50259 1 154 . 1 . 1 32 32 ASN H H 1 8.167 0.00 . . . . . . . 500 ASN H . 50259 1 155 . 1 . 1 32 32 ASN C C 13 171.477 0.00 . . . . . . . 500 ASN CO . 50259 1 156 . 1 . 1 32 32 ASN CA C 13 50.240 0.06 . . . . . . . 500 ASN CA . 50259 1 157 . 1 . 1 32 32 ASN CB C 13 36.431 0.07 . . . . . . . 500 ASN CB . 50259 1 158 . 1 . 1 32 32 ASN N N 15 120.528 0.00 . . . . . . . 500 ASN N . 50259 1 159 . 1 . 1 33 33 PHE H H 1 7.972 0.00 . . . . . . . 501 PHE H . 50259 1 160 . 1 . 1 33 33 PHE C C 13 172.358 0.00 . . . . . . . 501 PHE CO . 50259 1 161 . 1 . 1 33 33 PHE CA C 13 54.852 0.01 . . . . . . . 501 PHE CA . 50259 1 162 . 1 . 1 33 33 PHE CB C 13 36.924 0.09 . . . . . . . 501 PHE CB . 50259 1 163 . 1 . 1 33 33 PHE N N 15 121.169 0.02 . . . . . . . 501 PHE N . 50259 1 164 . 1 . 1 34 34 GLU H H 1 8.160 0.00 . . . . . . . 502 GLU H . 50259 1 165 . 1 . 1 34 34 GLU C C 13 171.088 0.00 . . . . . . . 502 GLU CO . 50259 1 166 . 1 . 1 34 34 GLU CA C 13 51.052 0.00 . . . . . . . 502 GLU CA . 50259 1 167 . 1 . 1 34 34 GLU CB C 13 27.466 0.00 . . . . . . . 502 GLU CB . 50259 1 168 . 1 . 1 34 34 GLU N N 15 124.569 0.00 . . . . . . . 502 GLU N . 50259 1 stop_ save_