data_53241 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 53241 _Entry.Title ; DNAJA1 J-domain DDDD phosphomimetic ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2025-06-24 _Entry.Accession_date 2025-06-24 _Entry.Last_release_date 2025-06-24 _Entry.Original_release_date 2025-06-24 _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 'T5D T6D Y7D Y8D' _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 Anna Leder . . . . 53241 2 Guillaume Mas . . . . 53241 3 Sebastian Hiller . . . . 53241 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Biozentrum, University of Basel, Switzerland' . 53241 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 53241 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 57 53241 '1H chemical shifts' 57 53241 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 . . 2025-11-06 . original BMRB . 53241 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 53239 'DNAJA1 J-domain' 53241 BMRB 53240 'DNAJA1 J-domain T5D' 53241 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 53241 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; A universal tyrosine-based regulatory switch controls J-domain protein activity ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _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 . _Citation.Page_last . _Citation.Year . _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 Anna Leder . . . . 53241 1 2 Guillaume Mas . . . . 53241 1 3 Sebastian Hiller . . . . 53241 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 53241 _Assembly.ID 1 _Assembly.Name 'DNAJA1 JD T5D T6D Y7D Y8D' _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 'DNAJA1 JD T5D T6D Y7D Y8D' 1 $entity_1 . . yes native no no . . . 53241 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 53241 _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 ; MVKEDDDDDVLGVKPNATQE ELKKAYRKLALKYHPDKNPN EGEKFKQISQAYEVLSDAKK RELYDKGGEQAIKEGC ; _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 76 _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 . MET . 53241 1 2 . VAL . 53241 1 3 . LYS . 53241 1 4 . GLU . 53241 1 5 . ASP . 53241 1 6 . ASP . 53241 1 7 . ASP . 53241 1 8 . ASP . 53241 1 9 . ASP . 53241 1 10 . VAL . 53241 1 11 . LEU . 53241 1 12 . GLY . 53241 1 13 . VAL . 53241 1 14 . LYS . 53241 1 15 . PRO . 53241 1 16 . ASN . 53241 1 17 . ALA . 53241 1 18 . THR . 53241 1 19 . GLN . 53241 1 20 . GLU . 53241 1 21 . GLU . 53241 1 22 . LEU . 53241 1 23 . LYS . 53241 1 24 . LYS . 53241 1 25 . ALA . 53241 1 26 . TYR . 53241 1 27 . ARG . 53241 1 28 . LYS . 53241 1 29 . LEU . 53241 1 30 . ALA . 53241 1 31 . LEU . 53241 1 32 . LYS . 53241 1 33 . TYR . 53241 1 34 . HIS . 53241 1 35 . PRO . 53241 1 36 . ASP . 53241 1 37 . LYS . 53241 1 38 . ASN . 53241 1 39 . PRO . 53241 1 40 . ASN . 53241 1 41 . GLU . 53241 1 42 . GLY . 53241 1 43 . GLU . 53241 1 44 . LYS . 53241 1 45 . PHE . 53241 1 46 . LYS . 53241 1 47 . GLN . 53241 1 48 . ILE . 53241 1 49 . SER . 53241 1 50 . GLN . 53241 1 51 . ALA . 53241 1 52 . TYR . 53241 1 53 . GLU . 53241 1 54 . VAL . 53241 1 55 . LEU . 53241 1 56 . SER . 53241 1 57 . ASP . 53241 1 58 . ALA . 53241 1 59 . LYS . 53241 1 60 . LYS . 53241 1 61 . ARG . 53241 1 62 . GLU . 53241 1 63 . LEU . 53241 1 64 . TYR . 53241 1 65 . ASP . 53241 1 66 . LYS . 53241 1 67 . GLY . 53241 1 68 . GLY . 53241 1 69 . GLU . 53241 1 70 . GLN . 53241 1 71 . ALA . 53241 1 72 . ILE . 53241 1 73 . LYS . 53241 1 74 . GLU . 53241 1 75 . GLY . 53241 1 76 . CYS . 53241 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 . MET 1 1 53241 1 . VAL 2 2 53241 1 . LYS 3 3 53241 1 . GLU 4 4 53241 1 . ASP 5 5 53241 1 . ASP 6 6 53241 1 . ASP 7 7 53241 1 . ASP 8 8 53241 1 . ASP 9 9 53241 1 . VAL 10 10 53241 1 . LEU 11 11 53241 1 . GLY 12 12 53241 1 . VAL 13 13 53241 1 . LYS 14 14 53241 1 . PRO 15 15 53241 1 . ASN 16 16 53241 1 . ALA 17 17 53241 1 . THR 18 18 53241 1 . GLN 19 19 53241 1 . GLU 20 20 53241 1 . GLU 21 21 53241 1 . LEU 22 22 53241 1 . LYS 23 23 53241 1 . LYS 24 24 53241 1 . ALA 25 25 53241 1 . TYR 26 26 53241 1 . ARG 27 27 53241 1 . LYS 28 28 53241 1 . LEU 29 29 53241 1 . ALA 30 30 53241 1 . LEU 31 31 53241 1 . LYS 32 32 53241 1 . TYR 33 33 53241 1 . HIS 34 34 53241 1 . PRO 35 35 53241 1 . ASP 36 36 53241 1 . LYS 37 37 53241 1 . ASN 38 38 53241 1 . PRO 39 39 53241 1 . ASN 40 40 53241 1 . GLU 41 41 53241 1 . GLY 42 42 53241 1 . GLU 43 43 53241 1 . LYS 44 44 53241 1 . PHE 45 45 53241 1 . LYS 46 46 53241 1 . GLN 47 47 53241 1 . ILE 48 48 53241 1 . SER 49 49 53241 1 . GLN 50 50 53241 1 . ALA 51 51 53241 1 . TYR 52 52 53241 1 . GLU 53 53 53241 1 . VAL 54 54 53241 1 . LEU 55 55 53241 1 . SER 56 56 53241 1 . ASP 57 57 53241 1 . ALA 58 58 53241 1 . LYS 59 59 53241 1 . LYS 60 60 53241 1 . ARG 61 61 53241 1 . GLU 62 62 53241 1 . LEU 63 63 53241 1 . TYR 64 64 53241 1 . ASP 65 65 53241 1 . LYS 66 66 53241 1 . GLY 67 67 53241 1 . GLY 68 68 53241 1 . GLU 69 69 53241 1 . GLN 70 70 53241 1 . ALA 71 71 53241 1 . ILE 72 72 53241 1 . LYS 73 73 53241 1 . GLU 74 74 53241 1 . GLY 75 75 53241 1 . CYS 76 76 53241 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 53241 _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 . . . . . . . . . . . . . 53241 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 53241 _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 . . pCA528 . . . 53241 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 53241 _Sample.ID 1 _Sample.Name 'DNAJA1 JD T5D T6D Y7D Y8D' _Sample.Type solution _Sample.Sub_type . _Sample.Details 'buffer: MES 25 mM (pH 7.5), KCl 150 mM, MgCl2 10 mM' _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 'DNAJA1 JD T5D T6D Y7D Y8D' '[U-98% 15N]' . . 1 $entity_1 . . 0.75 0.5 1 mM . . . . 53241 1 2 MES 'natural abundance' . . . . . . 25 . . mM . . . . 53241 1 3 'potassium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 53241 1 4 'magnesium chloride' 'natural abundance' . . . . . . 10 . . mM . . . . 53241 1 5 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 53241 1 6 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . 53241 1 7 D2O 'natural abundance' . . . . . . 10 . . % . . . . 53241 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 53241 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'DNAJA1 JD T5D T6D Y7D Y8D' _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' 150 . mM 53241 1 pH 6.5 . pH 53241 1 pressure 1 . atm 53241 1 temperature 298 . K 53241 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 53241 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version 2.5.2 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 53241 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 53241 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '700 MHz Bruker' _NMR_spectrometer.Details 'cryo probe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 53241 _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 no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53241 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 53241 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'DNAJA1 JD T5D T6D Y7D Y8D' _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1 . . . . . 53241 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect . . . . . . 53241 1 stop_ save_ save_chem_shift_reference_2 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_2 _Chem_shift_reference.Entry_ID 53241 _Chem_shift_reference.ID 2 _Chem_shift_reference.Name 'DNAJA1 JD T5D T6D Y7D Y8D' _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1 . . . . . 53241 2 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect . . . . . . 53241 2 stop_ save_ save_chem_shift_reference_3 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_3 _Chem_shift_reference.Entry_ID 53241 _Chem_shift_reference.ID 3 _Chem_shift_reference.Name 'DNAJA1 JD T5D T6D Y7D Y8D' _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1 . . . . . 53241 3 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect . . . . . . 53241 3 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 53241 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'DNAJA1 JD T5D T6D Y7D Y8D' _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' . . . 53241 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 . . 53241 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 3 3 LYS H H 1 8.357 . . 1 . . . . . 3 LYS H . 53241 1 2 . 1 . 1 3 3 LYS N N 15 126.488 . . 1 . . . . . 3 LYS N . 53241 1 3 . 1 . 1 4 4 GLU H H 1 8.501 . . 1 . . . . . 4 GLU H . 53241 1 4 . 1 . 1 4 4 GLU N N 15 123.867 . . 1 . . . . . 4 GLU N . 53241 1 5 . 1 . 1 5 5 ASP H H 1 8.22 . . 1 . . . . . 5 ASP H . 53241 1 6 . 1 . 1 5 5 ASP N N 15 121.223 . . 1 . . . . . 5 ASP N . 53241 1 7 . 1 . 1 7 7 ASP H H 1 8.166 . . 1 . . . . . 7 ASP H . 53241 1 8 . 1 . 1 7 7 ASP N N 15 121.223 . . 1 . . . . . 7 ASP N . 53241 1 9 . 1 . 1 8 8 ASP H H 1 8.152 . . 1 . . . . . 8 ASP H . 53241 1 10 . 1 . 1 8 8 ASP N N 15 121.374 . . 1 . . . . . 8 ASP N . 53241 1 11 . 1 . 1 9 9 ASP H H 1 8.084 . . 1 . . . . . 9 ASP H . 53241 1 12 . 1 . 1 9 9 ASP N N 15 117.205 . . 1 . . . . . 9 ASP N . 53241 1 13 . 1 . 1 10 10 VAL H H 1 7.872 . . 1 . . . . . 10 VAL H . 53241 1 14 . 1 . 1 10 10 VAL N N 15 120.45 . . 1 . . . . . 10 VAL N . 53241 1 15 . 1 . 1 12 12 GLY H H 1 8.036 . . 1 . . . . . 12 GLY H . 53241 1 16 . 1 . 1 12 12 GLY N N 15 109.361 . . 1 . . . . . 12 GLY N . 53241 1 17 . 1 . 1 13 13 VAL H H 1 7.742 . . 1 . . . . . 13 VAL H . 53241 1 18 . 1 . 1 13 13 VAL N N 15 119.225 . . 1 . . . . . 13 VAL N . 53241 1 19 . 1 . 1 14 14 LYS H H 1 8.289 . . 1 . . . . . 14 LYS H . 53241 1 20 . 1 . 1 14 14 LYS N N 15 126.961 . . 1 . . . . . 14 LYS N . 53241 1 21 . 1 . 1 16 16 ASN H H 1 8.323 . . 1 . . . . . 16 ASN H . 53241 1 22 . 1 . 1 16 16 ASN N N 15 118.15 . . 1 . . . . . 16 ASN N . 53241 1 23 . 1 . 1 17 17 ALA H H 1 7.878 . . 1 . . . . . 17 ALA H . 53241 1 24 . 1 . 1 17 17 ALA N N 15 124.404 . . 1 . . . . . 17 ALA N . 53241 1 25 . 1 . 1 18 18 THR H H 1 8.193 . . 1 . . . . . 18 THR H . 53241 1 26 . 1 . 1 18 18 THR N N 15 113.423 . . 1 . . . . . 18 THR N . 53241 1 27 . 1 . 1 19 19 GLN H H 1 8.473 . . 1 . . . . . 19 GLN H . 53241 1 28 . 1 . 1 19 19 GLN N N 15 121.374 . . 1 . . . . . 19 GLN N . 53241 1 29 . 1 . 1 20 20 GLU H H 1 8.302 . . 1 . . . . . 20 GLU H . 53241 1 30 . 1 . 1 20 20 GLU N N 15 120.385 . . 1 . . . . . 20 GLU N . 53241 1 31 . 1 . 1 21 21 GLU H H 1 7.899 . . 1 . . . . . 21 GLU H . 53241 1 32 . 1 . 1 21 21 GLU N N 15 120.987 . . 1 . . . . . 21 GLU N . 53241 1 33 . 1 . 1 22 22 LEU H H 1 8.029 . . 1 . . . . . 22 LEU H . 53241 1 34 . 1 . 1 22 22 LEU N N 15 122.126 . . 1 . . . . . 22 LEU N . 53241 1 35 . 1 . 1 23 23 LYS H H 1 7.899 . . 1 . . . . . 23 LYS H . 53241 1 36 . 1 . 1 23 23 LYS N N 15 119.977 . . 1 . . . . . 23 LYS N . 53241 1 37 . 1 . 1 24 24 LYS H H 1 7.707 . . 1 . . . . . 24 LYS H . 53241 1 38 . 1 . 1 24 24 LYS N N 15 120.127 . . 1 . . . . . 24 LYS N . 53241 1 39 . 1 . 1 25 25 ALA H H 1 7.824 . . 1 . . . . . 25 ALA H . 53241 1 40 . 1 . 1 25 25 ALA N N 15 123.372 . . 1 . . . . . 25 ALA N . 53241 1 41 . 1 . 1 26 26 TYR H H 1 8.063 . . 1 . . . . . 26 TYR H . 53241 1 42 . 1 . 1 26 26 TYR N N 15 119.182 . . 1 . . . . . 26 TYR N . 53241 1 43 . 1 . 1 27 27 ARG H H 1 7.872 . . 1 . . . . . 27 ARG H . 53241 1 44 . 1 . 1 27 27 ARG N N 15 121.438 . . 1 . . . . . 27 ARG N . 53241 1 45 . 1 . 1 29 29 LEU H H 1 7.776 . . 1 . . . . . 29 LEU H . 53241 1 46 . 1 . 1 29 29 LEU N N 15 121.975 . . 1 . . . . . 29 LEU N . 53241 1 47 . 1 . 1 30 30 ALA H H 1 7.974 . . 1 . . . . . 30 ALA H . 53241 1 48 . 1 . 1 30 30 ALA N N 15 123.501 . . 1 . . . . . 30 ALA N . 53241 1 49 . 1 . 1 31 31 LEU H H 1 7.701 . . 1 . . . . . 31 LEU H . 53241 1 50 . 1 . 1 31 31 LEU N N 15 119.977 . . 1 . . . . . 31 LEU N . 53241 1 51 . 1 . 1 33 33 TYR H H 1 8.248 . . 1 . . . . . 33 TYR H . 53241 1 52 . 1 . 1 33 33 TYR N N 15 121.245 . . 1 . . . . . 33 TYR N . 53241 1 53 . 1 . 1 34 34 HIS H H 1 7.803 . . 1 . . . . . 34 HIS H . 53241 1 54 . 1 . 1 34 34 HIS N N 15 120.45 . . 1 . . . . . 34 HIS N . 53241 1 55 . 1 . 1 37 37 LYS H H 1 7.974 . . 1 . . . . . 37 LYS H . 53241 1 56 . 1 . 1 37 37 LYS N N 15 121.202 . . 1 . . . . . 37 LYS N . 53241 1 57 . 1 . 1 38 38 ASN H H 1 8.371 . . 1 . . . . . 38 ASN H . 53241 1 58 . 1 . 1 38 38 ASN N N 15 121.675 . . 1 . . . . . 38 ASN N . 53241 1 59 . 1 . 1 40 40 ASN H H 1 8.282 . . 1 . . . . . 40 ASN H . 53241 1 60 . 1 . 1 40 40 ASN N N 15 118.193 . . 1 . . . . . 40 ASN N . 53241 1 61 . 1 . 1 41 41 GLU H H 1 7.995 . . 1 . . . . . 41 GLU H . 53241 1 62 . 1 . 1 41 41 GLU N N 15 121.61 . . 1 . . . . . 41 GLU N . 53241 1 63 . 1 . 1 42 42 GLY H H 1 8.261 . . 1 . . . . . 42 GLY H . 53241 1 64 . 1 . 1 42 42 GLY N N 15 109.77 . . 1 . . . . . 42 GLY N . 53241 1 65 . 1 . 1 43 43 GLU H H 1 8.077 . . 1 . . . . . 43 GLU H . 53241 1 66 . 1 . 1 43 43 GLU N N 15 121.395 . . 1 . . . . . 43 GLU N . 53241 1 67 . 1 . 1 44 44 LYS H H 1 8.063 . . 1 . . . . . 44 LYS H . 53241 1 68 . 1 . 1 44 44 LYS N N 15 121.804 . . 1 . . . . . 44 LYS N . 53241 1 69 . 1 . 1 45 45 PHE H H 1 7.954 . . 1 . . . . . 45 PHE H . 53241 1 70 . 1 . 1 45 45 PHE N N 15 120.127 . . 1 . . . . . 45 PHE N . 53241 1 71 . 1 . 1 49 49 SER H H 1 8.152 . . 1 . . . . . 49 SER H . 53241 1 72 . 1 . 1 49 49 SER N N 15 119.397 . . 1 . . . . . 49 SER N . 53241 1 73 . 1 . 1 50 50 GLN H H 1 8.193 . . 1 . . . . . 50 GLN H . 53241 1 74 . 1 . 1 50 50 GLN N N 15 122.835 . . 1 . . . . . 50 GLN N . 53241 1 75 . 1 . 1 51 51 ALA H H 1 8.008 . . 1 . . . . . 51 ALA H . 53241 1 76 . 1 . 1 51 51 ALA N N 15 124.662 . . 1 . . . . . 51 ALA N . 53241 1 77 . 1 . 1 52 52 TYR H H 1 7.851 . . 1 . . . . . 52 TYR H . 53241 1 78 . 1 . 1 52 52 TYR N N 15 119.118 . . 1 . . . . . 52 TYR N . 53241 1 79 . 1 . 1 54 54 VAL H H 1 7.885 . . 1 . . . . . 54 VAL H . 53241 1 80 . 1 . 1 54 54 VAL N N 15 121.073 . . 1 . . . . . 54 VAL N . 53241 1 81 . 1 . 1 57 57 ASP H H 1 8.275 . . 1 . . . . . 57 ASP H . 53241 1 82 . 1 . 1 57 57 ASP N N 15 122.857 . . 1 . . . . . 57 ASP N . 53241 1 83 . 1 . 1 59 59 LYS H H 1 7.885 . . 1 . . . . . 59 LYS H . 53241 1 84 . 1 . 1 59 59 LYS N N 15 119.612 . . 1 . . . . . 59 LYS N . 53241 1 85 . 1 . 1 60 60 LYS H H 1 8.002 . . 1 . . . . . 60 LYS H . 53241 1 86 . 1 . 1 60 60 LYS N N 15 121.503 . . 1 . . . . . 60 LYS N . 53241 1 87 . 1 . 1 61 61 ARG H H 1 7.919 . . 1 . . . . . 61 ARG H . 53241 1 88 . 1 . 1 61 61 ARG N N 15 120.88 . . 1 . . . . . 61 ARG N . 53241 1 89 . 1 . 1 62 62 GLU H H 1 7.967 . . 1 . . . . . 62 GLU H . 53241 1 90 . 1 . 1 62 62 GLU N N 15 121.03 . . 1 . . . . . 62 GLU N . 53241 1 91 . 1 . 1 63 63 LEU H H 1 7.844 . . 1 . . . . . 63 LEU H . 53241 1 92 . 1 . 1 63 63 LEU N N 15 121.18 . . 1 . . . . . 63 LEU N . 53241 1 93 . 1 . 1 64 64 TYR H H 1 7.824 . . 1 . . . . . 64 TYR H . 53241 1 94 . 1 . 1 64 64 TYR N N 15 119.891 . . 1 . . . . . 64 TYR N . 53241 1 95 . 1 . 1 65 65 ASP H H 1 8.097 . . 1 . . . . . 65 ASP H . 53241 1 96 . 1 . 1 65 65 ASP N N 15 122.19 . . 1 . . . . . 65 ASP N . 53241 1 97 . 1 . 1 66 66 LYS H H 1 8.008 . . 1 . . . . . 66 LYS H . 53241 1 98 . 1 . 1 66 66 LYS N N 15 121.89 . . 1 . . . . . 66 LYS N . 53241 1 99 . 1 . 1 67 67 GLY H H 1 8.248 . . 1 . . . . . 67 GLY H . 53241 1 100 . 1 . 1 67 67 GLY N N 15 109.641 . . 1 . . . . . 67 GLY N . 53241 1 101 . 1 . 1 68 68 GLY H H 1 8.097 . . 1 . . . . . 68 GLY H . 53241 1 102 . 1 . 1 68 68 GLY N N 15 109.361 . . 1 . . . . . 68 GLY N . 53241 1 103 . 1 . 1 71 71 ALA H H 1 8.049 . . 1 . . . . . 71 ALA H . 53241 1 104 . 1 . 1 71 71 ALA N N 15 125.478 . . 1 . . . . . 71 ALA N . 53241 1 105 . 1 . 1 72 72 ILE H H 1 7.906 . . 1 . . . . . 72 ILE H . 53241 1 106 . 1 . 1 72 72 ILE N N 15 120.665 . . 1 . . . . . 72 ILE N . 53241 1 107 . 1 . 1 73 73 LYS H H 1 8.179 . . 1 . . . . . 73 LYS H . 53241 1 108 . 1 . 1 73 73 LYS N N 15 126.381 . . 1 . . . . . 73 LYS N . 53241 1 109 . 1 . 1 74 74 GLU H H 1 8.289 . . 1 . . . . . 74 GLU H . 53241 1 110 . 1 . 1 74 74 GLU N N 15 123.265 . . 1 . . . . . 74 GLU N . 53241 1 111 . 1 . 1 75 75 GLY H H 1 8.35 . . 1 . . . . . 75 GLY H . 53241 1 112 . 1 . 1 75 75 GLY N N 15 111.338 . . 1 . . . . . 75 GLY N . 53241 1 113 . 1 . 1 76 76 CYS H H 1 7.735 . . 1 . . . . . 76 CYS H . 53241 1 114 . 1 . 1 76 76 CYS N N 15 123.415 . . 1 . . . . . 76 CYS N . 53241 1 stop_ save_