data_26520 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26520 _Entry.Title ; Studying Invisible Excited Protein States in Slow Exchange with a Major State Conformation ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-02-24 _Entry.Accession_date 2015-02-24 _Entry.Last_release_date 2015-03-09 _Entry.Original_release_date 2015-03-09 _Entry.Origination BMRB _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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.Entry_ID 1 Pramodh Vallurupalli . . . 26520 2 Guillaume Bouvignies . . . 26520 3 Lewis Kay . E. . 26520 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Departments of Molecular Genetics, Biochemistry, and Chemistry, The University of Toronto, Toronto, Ontario, Canada M5S 1A8' . 26520 2 . 'Program in Molecular Structure and Function, Hospital for Sick Children, Toronto, Ontario, Canada M5G 1X8' . 26520 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID heteronucl_T1_relaxation 1 26520 heteronucl_T2_relaxation 2 26520 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'T1 relaxation values' 65 26520 'T2 relaxation values' 130 26520 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 . . 2015-03-09 2015-02-24 original author . 26520 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26519 'Abp1p-Ark1p system' 26520 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26520 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22554188 _Citation.Full_citation . _Citation.Title 'Studying Invisible Excited Protein States in Slow Exchange with a Major State Conformation' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 134 _Citation.Journal_issue 19 _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 8148 _Citation.Page_last 8161 _Citation.Year 2012 _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.Entry_ID _Citation_author.Citation_ID 1 Pramodh Vallurupalli . . . 26520 1 2 Guillaume Bouvignies . . . 26520 1 3 Lewis Kay . E. . 26520 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26520 _Assembly.ID 1 _Assembly.Name 'A39G FF domain' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _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 'A39G FF domain' 1 $A39G_FF A . yes native no no . . . 26520 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_A39G_FF _Entity.Sf_category entity _Entity.Sf_framecode A39G_FF _Entity.Entry_ID 26520 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name A39G_FF _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 ; ESQPAKKTYTWNTKEEAKQA FKELLKEKRVPSNASWEQAM KMIINDPRYSALAKLSEKKQ AFNAYKVQTEK ; _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 71 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _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 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 17489 . FF_Domain_L24A . . . . . 98.59 70 98.57 98.57 1.17e-39 . . . . 26520 1 2 no BMRB 18010 . FF11-60 . . . . . 69.01 50 100.00 100.00 1.53e-24 . . . . 26520 1 3 no BMRB 19591 . FF_domain_L24A_mutant . . . . . 98.59 71 98.57 98.57 9.91e-40 . . . . 26520 1 4 no PDB 1UZC . "The Structure Of An Ff Domain From Human HypaFBP11" . . . . . 98.59 71 100.00 100.00 1.30e-40 . . . . 26520 1 5 no PDB 2KZG . "A Transient And Low Populated Protein Folding Intermediate At Atomic Resolution" . . . . . 98.59 71 100.00 100.00 1.30e-40 . . . . 26520 1 6 no PDB 2L9V . "Nmr Structure Of The Ff Domain L24a Mutant's Folding Transition State" . . . . . 69.01 49 97.96 97.96 6.11e-24 . . . . 26520 1 7 no PDB 2LKS . Ff11-60 . . . . . 69.01 50 100.00 100.00 1.53e-24 . . . . 26520 1 8 no DBJ BAB15016 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 323 100.00 100.00 8.36e-40 . . . . 26520 1 9 no DBJ BAG60744 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 816 100.00 100.00 4.38e-38 . . . . 26520 1 10 no GB AAC27501 . "huntingtin-interacting protein HYPA/FBP11 [Homo sapiens]" . . . . . 97.18 423 98.55 98.55 7.09e-38 . . . . 26520 1 11 no GB AAC27506 . "huntingtin-interacting protein HYPA/FBP11 [Homo sapiens]" . . . . . 97.18 452 98.55 98.55 1.02e-37 . . . . 26520 1 12 no GB AAD39463 . "formin binding protein 11 [Mus musculus]" . . . . . 100.00 953 100.00 100.00 8.17e-38 . . . . 26520 1 13 no GB AAH11788 . "PRPF40A protein, partial [Homo sapiens]" . . . . . 100.00 411 98.59 100.00 7.07e-39 . . . . 26520 1 14 no GB AAH29414 . "PRPF40A protein, partial [Homo sapiens]" . . . . . 100.00 414 97.18 98.59 9.68e-38 . . . . 26520 1 15 no REF NP_001099950 . "pre-mRNA-processing factor 40 homolog A [Rattus norvegicus]" . . . . . 100.00 953 100.00 100.00 8.25e-38 . . . . 26520 1 16 no REF NP_001231502 . "pre-mRNA-processing factor 40 homolog A [Sus scrofa]" . . . . . 100.00 957 98.59 100.00 2.45e-37 . . . . 26520 1 17 no REF NP_060362 . "pre-mRNA-processing factor 40 homolog A [Homo sapiens]" . . . . . 100.00 930 100.00 100.00 6.62e-38 . . . . 26520 1 18 no REF NP_061255 . "pre-mRNA-processing factor 40 homolog A [Mus musculus]" . . . . . 100.00 953 100.00 100.00 8.17e-38 . . . . 26520 1 19 no REF XP_001365479 . "PREDICTED: pre-mRNA-processing factor 40 homolog A isoform X1 [Monodelphis domestica]" . . . . . 100.00 1038 98.59 100.00 2.42e-37 . . . . 26520 1 20 no SP O75400 . "RecName: Full=Pre-mRNA-processing factor 40 homolog A; AltName: Full=Fas ligand-associated factor 1; AltName: Full=Formin-bindi" . . . . . 100.00 957 100.00 100.00 8.00e-38 . . . . 26520 1 21 no SP Q9R1C7 . "RecName: Full=Pre-mRNA-processing factor 40 homolog A; AltName: Full=Formin-binding protein 11; Short=FBP-11; AltName: Full=For" . . . . . 100.00 953 100.00 100.00 8.17e-38 . . . . 26520 1 22 no TPG DAA32724 . "TPA: formin binding protein 3-like [Bos taurus]" . . . . . 100.00 929 100.00 100.00 6.73e-38 . . . . 26520 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 GLU . 26520 1 2 2 SER . 26520 1 3 3 GLN . 26520 1 4 4 PRO . 26520 1 5 5 ALA . 26520 1 6 6 LYS . 26520 1 7 7 LYS . 26520 1 8 8 THR . 26520 1 9 9 TYR . 26520 1 10 10 THR . 26520 1 11 11 TRP . 26520 1 12 12 ASN . 26520 1 13 13 THR . 26520 1 14 14 LYS . 26520 1 15 15 GLU . 26520 1 16 16 GLU . 26520 1 17 17 ALA . 26520 1 18 18 LYS . 26520 1 19 19 GLN . 26520 1 20 20 ALA . 26520 1 21 21 PHE . 26520 1 22 22 LYS . 26520 1 23 23 GLU . 26520 1 24 24 LEU . 26520 1 25 25 LEU . 26520 1 26 26 LYS . 26520 1 27 27 GLU . 26520 1 28 28 LYS . 26520 1 29 29 ARG . 26520 1 30 30 VAL . 26520 1 31 31 PRO . 26520 1 32 32 SER . 26520 1 33 33 ASN . 26520 1 34 34 ALA . 26520 1 35 35 SER . 26520 1 36 36 TRP . 26520 1 37 37 GLU . 26520 1 38 38 GLN . 26520 1 39 39 ALA . 26520 1 40 40 MET . 26520 1 41 41 LYS . 26520 1 42 42 MET . 26520 1 43 43 ILE . 26520 1 44 44 ILE . 26520 1 45 45 ASN . 26520 1 46 46 ASP . 26520 1 47 47 PRO . 26520 1 48 48 ARG . 26520 1 49 49 TYR . 26520 1 50 50 SER . 26520 1 51 51 ALA . 26520 1 52 52 LEU . 26520 1 53 53 ALA . 26520 1 54 54 LYS . 26520 1 55 55 LEU . 26520 1 56 56 SER . 26520 1 57 57 GLU . 26520 1 58 58 LYS . 26520 1 59 59 LYS . 26520 1 60 60 GLN . 26520 1 61 61 ALA . 26520 1 62 62 PHE . 26520 1 63 63 ASN . 26520 1 64 64 ALA . 26520 1 65 65 TYR . 26520 1 66 66 LYS . 26520 1 67 67 VAL . 26520 1 68 68 GLN . 26520 1 69 69 THR . 26520 1 70 70 GLU . 26520 1 71 71 LYS . 26520 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 . GLU 1 1 26520 1 . SER 2 2 26520 1 . GLN 3 3 26520 1 . PRO 4 4 26520 1 . ALA 5 5 26520 1 . LYS 6 6 26520 1 . LYS 7 7 26520 1 . THR 8 8 26520 1 . TYR 9 9 26520 1 . THR 10 10 26520 1 . TRP 11 11 26520 1 . ASN 12 12 26520 1 . THR 13 13 26520 1 . LYS 14 14 26520 1 . GLU 15 15 26520 1 . GLU 16 16 26520 1 . ALA 17 17 26520 1 . LYS 18 18 26520 1 . GLN 19 19 26520 1 . ALA 20 20 26520 1 . PHE 21 21 26520 1 . LYS 22 22 26520 1 . GLU 23 23 26520 1 . LEU 24 24 26520 1 . LEU 25 25 26520 1 . LYS 26 26 26520 1 . GLU 27 27 26520 1 . LYS 28 28 26520 1 . ARG 29 29 26520 1 . VAL 30 30 26520 1 . PRO 31 31 26520 1 . SER 32 32 26520 1 . ASN 33 33 26520 1 . ALA 34 34 26520 1 . SER 35 35 26520 1 . TRP 36 36 26520 1 . GLU 37 37 26520 1 . GLN 38 38 26520 1 . ALA 39 39 26520 1 . MET 40 40 26520 1 . LYS 41 41 26520 1 . MET 42 42 26520 1 . ILE 43 43 26520 1 . ILE 44 44 26520 1 . ASN 45 45 26520 1 . ASP 46 46 26520 1 . PRO 47 47 26520 1 . ARG 48 48 26520 1 . TYR 49 49 26520 1 . SER 50 50 26520 1 . ALA 51 51 26520 1 . LEU 52 52 26520 1 . ALA 53 53 26520 1 . LYS 54 54 26520 1 . LEU 55 55 26520 1 . SER 56 56 26520 1 . GLU 57 57 26520 1 . LYS 58 58 26520 1 . LYS 59 59 26520 1 . GLN 60 60 26520 1 . ALA 61 61 26520 1 . PHE 62 62 26520 1 . ASN 63 63 26520 1 . ALA 64 64 26520 1 . TYR 65 65 26520 1 . LYS 66 66 26520 1 . VAL 67 67 26520 1 . GLN 68 68 26520 1 . THR 69 69 26520 1 . GLU 70 70 26520 1 . LYS 71 71 26520 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 26520 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $A39G_FF . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 26520 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 26520 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $A39G_FF . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pRSET . . . . . . 26520 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26520 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _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 A39G_FF '[U-100% 15N]' . . 1 $A39G_FF . . 2 . . mM . . . . 26520 1 2 'sodium acetate' 'natural abundance' . . . . . . 50 . . mM . . . . 26520 1 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 26520 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26520 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26520 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 26520 _Sample_condition_list.ID 1 _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 temperature 274 . K 26520 1 pH 5.7 . pH 26520 1 pressure 1 . atm 26520 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 26520 _Software.ID 1 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 26520 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID Visualization 26520 1 stop_ save_ save_CATIA _Software.Sf_category software _Software.Sf_framecode CATIA _Software.Entry_ID 26520 _Software.ID 2 _Software.Name CATIA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bloch McConnell' . . 26520 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 26520 2 stop_ save_ save_NMRpipe _Software.Sf_category software _Software.Sf_framecode NMRpipe _Software.Entry_ID 26520 _Software.ID 3 _Software.Name NMRpipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26520 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26520 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26520 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 26520 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian Inova . 500 . . . 26520 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 26520 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_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.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26520 1 2 '2D 1H-15N HMQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26520 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_heteronuclear_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode heteronuclear_T1_list_1 _Heteronucl_T1_list.Entry_ID 26520 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 500 _Heteronucl_T1_list.T1_coherence_type Sz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details ; Ground State Values of obtained from fits of all CEST profiles recorded on the A39G FF domain, 1C, 11.7T to a global two-site exchange processes. Values of (kex,pE) were fixed to (51.6 s-1,1.65%) and profiles for all of the residues fit simultaneously. The 37 residues that showed clear evidence for a second state are as follows (well resolved dips for both ground and excited states in profiles) 10 13 15 18 22 25 26 27 28 29 33 37 38 39 41 42 43 44 45 48 50 51 52 53 54 55 56 59 60 61 63 64 65 66 67 68 69 ; _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 1 '2D 1H-15N HSQC' . . . 26520 1 2 '2D 1H-15N HMQC' . . . 26520 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 3 3 GLN N N 15 1.19 0.01 . . . . . 26520 1 2 . 1 1 5 5 ALA N N 15 1.43 0.01 . . . . . 26520 1 3 . 1 1 6 6 LYS N N 15 1.49 0.01 . . . . . 26520 1 4 . 1 1 7 7 LYS N N 15 1.56 0.01 . . . . . 26520 1 5 . 1 1 8 8 THR N N 15 1.54 0.01 . . . . . 26520 1 6 . 1 1 9 9 TYR N N 15 1.53 0.01 . . . . . 26520 1 7 . 1 1 10 10 THR N N 15 1.45 0.01 . . . . . 26520 1 8 . 1 1 11 11 TRP N N 15 1.41 0.01 . . . . . 26520 1 9 . 1 1 12 12 ASN N N 15 1.37 0.01 . . . . . 26520 1 10 . 1 1 13 13 THR N N 15 1.23 0.01 . . . . . 26520 1 11 . 1 1 14 14 LYS N N 15 1.45 0.01 . . . . . 26520 1 12 . 1 1 15 15 GLU N N 15 1.39 0.01 . . . . . 26520 1 13 . 1 1 16 16 GLU N N 15 1.44 0.01 . . . . . 26520 1 14 . 1 1 17 17 ALA N N 15 1.47 0.01 . . . . . 26520 1 15 . 1 1 18 18 LYS N N 15 1.40 0.01 . . . . . 26520 1 16 . 1 1 19 19 GLN N N 15 1.41 0.01 . . . . . 26520 1 17 . 1 1 20 20 ALA N N 15 1.48 0.01 . . . . . 26520 1 18 . 1 1 21 21 PHE N N 15 1.52 0.01 . . . . . 26520 1 19 . 1 1 22 22 LYS N N 15 1.42 0.01 . . . . . 26520 1 20 . 1 1 23 23 GLU N N 15 1.44 0.01 . . . . . 26520 1 21 . 1 1 24 24 LEU N N 15 1.47 0.01 . . . . . 26520 1 22 . 1 1 25 25 LEU N N 15 1.46 0.01 . . . . . 26520 1 23 . 1 1 26 26 LYS N N 15 1.42 0.01 . . . . . 26520 1 24 . 1 1 27 27 GLU N N 15 1.43 0.01 . . . . . 26520 1 25 . 1 1 28 28 LYS N N 15 1.44 0.01 . . . . . 26520 1 26 . 1 1 29 29 ARG N N 15 1.41 0.01 . . . . . 26520 1 27 . 1 1 30 30 VAL N N 15 1.42 0.01 . . . . . 26520 1 28 . 1 1 32 32 SER N N 15 1.38 0.01 . . . . . 26520 1 29 . 1 1 33 33 ASN N N 15 1.48 0.01 . . . . . 26520 1 30 . 1 1 34 34 ALA N N 15 1.39 0.01 . . . . . 26520 1 31 . 1 1 35 35 SER N N 15 1.46 0.01 . . . . . 26520 1 32 . 1 1 36 36 TRP N N 15 1.43 0.01 . . . . . 26520 1 33 . 1 1 37 37 GLU N N 15 1.38 0.01 . . . . . 26520 1 34 . 1 1 38 38 GLN N N 15 1.41 0.01 . . . . . 26520 1 35 . 1 1 39 39 ALA N N 15 1.43 0.01 . . . . . 26520 1 36 . 1 1 40 40 MET N N 15 1.42 0.01 . . . . . 26520 1 37 . 1 1 41 41 LYS N N 15 1.36 0.01 . . . . . 26520 1 38 . 1 1 42 42 MET N N 15 1.41 0.01 . . . . . 26520 1 39 . 1 1 43 43 ILE N N 15 1.41 0.01 . . . . . 26520 1 40 . 1 1 44 44 ILE N N 15 1.38 0.01 . . . . . 26520 1 41 . 1 1 45 45 ASN N N 15 1.36 0.01 . . . . . 26520 1 42 . 1 1 46 46 ASP N N 15 1.17 0.01 . . . . . 26520 1 43 . 1 1 48 48 ARG N N 15 1.46 0.01 . . . . . 26520 1 44 . 1 1 50 50 SER N N 15 1.44 0.01 . . . . . 26520 1 45 . 1 1 51 51 ALA N N 15 1.48 0.01 . . . . . 26520 1 46 . 1 1 52 52 LEU N N 15 1.41 0.01 . . . . . 26520 1 47 . 1 1 53 53 ALA N N 15 1.33 0.01 . . . . . 26520 1 48 . 1 1 54 54 LYS N N 15 1.32 0.01 . . . . . 26520 1 49 . 1 1 55 55 LEU N N 15 1.45 0.01 . . . . . 26520 1 50 . 1 1 56 56 SER N N 15 1.41 0.01 . . . . . 26520 1 51 . 1 1 57 57 GLU N N 15 1.39 0.01 . . . . . 26520 1 52 . 1 1 58 58 LYS N N 15 1.47 0.01 . . . . . 26520 1 53 . 1 1 59 59 LYS N N 15 1.43 0.01 . . . . . 26520 1 54 . 1 1 60 60 GLN N N 15 1.38 0.01 . . . . . 26520 1 55 . 1 1 61 61 ALA N N 15 1.44 0.01 . . . . . 26520 1 56 . 1 1 62 62 PHE N N 15 1.47 0.01 . . . . . 26520 1 57 . 1 1 63 63 ASN N N 15 1.43 0.01 . . . . . 26520 1 58 . 1 1 64 64 ALA N N 15 1.41 0.01 . . . . . 26520 1 59 . 1 1 65 65 TYR N N 15 1.43 0.01 . . . . . 26520 1 60 . 1 1 66 66 LYS N N 15 1.45 0.01 . . . . . 26520 1 61 . 1 1 67 67 VAL N N 15 1.39 0.01 . . . . . 26520 1 62 . 1 1 68 68 GLN N N 15 1.46 0.01 . . . . . 26520 1 63 . 1 1 69 69 THR N N 15 1.56 0.01 . . . . . 26520 1 64 . 1 1 70 70 GLU N N 15 1.54 0.01 . . . . . 26520 1 65 . 1 1 71 71 LYS N N 15 1.50 0.01 . . . . . 26520 1 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_heteronuclear_T2_list_Ground _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_Ground _Heteronucl_T2_list.Entry_ID 26520 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method 'no calibration applied' _Heteronucl_T2_list.Temp_control_method 'no temperature control applied' _Heteronucl_T2_list.Spectrometer_frequency_1H 500 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details ; Ground State Values of obtained from fits of all CEST profiles recorded on the A39G FF domain, 1C, 11.7T to a global two-site exchange processes. Values of (kex,pE) were fixed to (51.6 s-1,1.65%) and profiles for all of the residues fit simultaneously. The 37 residues that showed clear evidence for a second state are as follows (well resolved dips for both ground and excited states in profiles) 10 13 15 18 22 25 26 27 28 29 33 37 38 39 41 42 43 44 45 48 50 51 52 53 54 55 56 59 60 61 63 64 65 66 67 68 69 ; _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 1 '2D 1H-15N HSQC' . . . 26520 1 2 '2D 1H-15N HMQC' . . . 26520 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 3 3 GLN N N 15 1.81 0.09 . . . . . . . 26520 1 2 . 1 1 5 5 ALA N N 15 2.74 0.08 . . . . . . . 26520 1 3 . 1 1 6 6 LYS N N 15 3.57 0.07 . . . . . . . 26520 1 4 . 1 1 7 7 LYS N N 15 5.07 0.06 . . . . . . . 26520 1 5 . 1 1 8 8 THR N N 15 8.33 0.07 . . . . . . . 26520 1 6 . 1 1 9 9 TYR N N 15 7.58 0.11 . . . . . . . 26520 1 7 . 1 1 10 10 THR N N 15 10.32 0.11 . . . . . . . 26520 1 8 . 1 1 11 11 TRP N N 15 16.17 0.33 . . . . . . . 26520 1 9 . 1 1 12 12 ASN N N 15 13.96 0.14 . . . . . . . 26520 1 10 . 1 1 13 13 THR N N 15 13.96 0.08 . . . . . . . 26520 1 11 . 1 1 14 14 LYS N N 15 11.67 0.15 . . . . . . . 26520 1 12 . 1 1 15 15 GLU N N 15 11.95 0.07 . . . . . . . 26520 1 13 . 1 1 16 16 GLU N N 15 11.16 0.09 . . . . . . . 26520 1 14 . 1 1 17 17 ALA N N 15 12.92 0.11 . . . . . . . 26520 1 15 . 1 1 18 18 LYS N N 15 12.31 0.09 . . . . . . . 26520 1 16 . 1 1 19 19 GLN N N 15 12.62 0.08 . . . . . . . 26520 1 17 . 1 1 20 20 ALA N N 15 12.79 0.40 . . . . . . . 26520 1 18 . 1 1 21 21 PHE N N 15 11.45 0.12 . . . . . . . 26520 1 19 . 1 1 22 22 LYS N N 15 12.42 0.08 . . . . . . . 26520 1 20 . 1 1 23 23 GLU N N 15 12.77 0.25 . . . . . . . 26520 1 21 . 1 1 24 24 LEU N N 15 12.27 0.17 . . . . . . . 26520 1 22 . 1 1 25 25 LEU N N 15 12.83 0.11 . . . . . . . 26520 1 23 . 1 1 26 26 LYS N N 15 12.54 0.08 . . . . . . . 26520 1 24 . 1 1 27 27 GLU N N 15 12.72 0.09 . . . . . . . 26520 1 25 . 1 1 28 28 LYS N N 15 11.91 0.09 . . . . . . . 26520 1 26 . 1 1 29 29 ARG N N 15 12.24 0.09 . . . . . . . 26520 1 27 . 1 1 30 30 VAL N N 15 12.66 0.08 . . . . . . . 26520 1 28 . 1 1 32 32 SER N N 15 11.04 0.10 . . . . . . . 26520 1 29 . 1 1 33 33 ASN N N 15 11.85 0.07 . . . . . . . 26520 1 30 . 1 1 34 34 ALA N N 15 12.24 0.07 . . . . . . . 26520 1 31 . 1 1 35 35 SER N N 15 11.26 0.07 . . . . . . . 26520 1 32 . 1 1 36 36 TRP N N 15 12.74 0.18 . . . . . . . 26520 1 33 . 1 1 37 37 GLU N N 15 12.85 0.09 . . . . . . . 26520 1 34 . 1 1 38 38 GLN N N 15 13.01 0.09 . . . . . . . 26520 1 35 . 1 1 39 39 ALA N N 15 12.71 0.10 . . . . . . . 26520 1 36 . 1 1 40 40 MET N N 15 14.08 0.09 . . . . . . . 26520 1 37 . 1 1 41 41 LYS N N 15 13.95 0.09 . . . . . . . 26520 1 38 . 1 1 42 42 MET N N 15 12.69 0.11 . . . . . . . 26520 1 39 . 1 1 43 43 ILE N N 15 12.71 0.12 . . . . . . . 26520 1 40 . 1 1 44 44 ILE N N 15 13.57 0.12 . . . . . . . 26520 1 41 . 1 1 45 45 ASN N N 15 13.16 0.07 . . . . . . . 26520 1 42 . 1 1 46 46 ASP N N 15 10.92 0.07 . . . . . . . 26520 1 43 . 1 1 48 48 ARG N N 15 12.06 0.10 . . . . . . . 26520 1 44 . 1 1 50 50 SER N N 15 12.18 0.08 . . . . . . . 26520 1 45 . 1 1 51 51 ALA N N 15 13.06 0.09 . . . . . . . 26520 1 46 . 1 1 52 52 LEU N N 15 14.19 0.21 . . . . . . . 26520 1 47 . 1 1 53 53 ALA N N 15 10.83 0.07 . . . . . . . 26520 1 48 . 1 1 54 54 LYS N N 15 10.51 0.06 . . . . . . . 26520 1 49 . 1 1 55 55 LEU N N 15 11.84 0.10 . . . . . . . 26520 1 50 . 1 1 56 56 SER N N 15 12.13 0.09 . . . . . . . 26520 1 51 . 1 1 57 57 GLU N N 15 12.68 0.11 . . . . . . . 26520 1 52 . 1 1 58 58 LYS N N 15 12.30 0.14 . . . . . . . 26520 1 53 . 1 1 59 59 LYS N N 15 12.77 0.12 . . . . . . . 26520 1 54 . 1 1 60 60 GLN N N 15 12.64 0.06 . . . . . . . 26520 1 55 . 1 1 61 61 ALA N N 15 12.91 0.08 . . . . . . . 26520 1 56 . 1 1 62 62 PHE N N 15 12.39 0.11 . . . . . . . 26520 1 57 . 1 1 63 63 ASN N N 15 12.33 0.07 . . . . . . . 26520 1 58 . 1 1 64 64 ALA N N 15 12.49 0.08 . . . . . . . 26520 1 59 . 1 1 65 65 TYR N N 15 11.88 0.09 . . . . . . . 26520 1 60 . 1 1 66 66 LYS N N 15 12.24 0.09 . . . . . . . 26520 1 61 . 1 1 67 67 VAL N N 15 12.16 0.07 . . . . . . . 26520 1 62 . 1 1 68 68 GLN N N 15 10.53 0.05 . . . . . . . 26520 1 63 . 1 1 69 69 THR N N 15 7.70 0.04 . . . . . . . 26520 1 64 . 1 1 70 70 GLU N N 15 6.73 0.03 . . . . . . . 26520 1 65 . 1 1 71 71 LYS N N 15 4.34 0.09 . . . . . . . 26520 1 stop_ save_ save_heteronuclear_T2_list_Excited _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_Excited _Heteronucl_T2_list.Entry_ID 26520 _Heteronucl_T2_list.ID 2 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method 'no calibration applied' _Heteronucl_T2_list.Temp_control_method 'no temperature control applied' _Heteronucl_T2_list.Spectrometer_frequency_1H 500 _Heteronucl_T2_list.T2_coherence_type S(+,-) _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details ; Excited State Values of obtained from fits of all CEST profiles recorded on the A39G FF domain, 1C, 11.7T to a global two-site exchange processes. Values of (kex,pE) were fixed to (51.6 s-1,1.65%) and profiles for all of the residues fit simultaneously. The 37 residues that showed clear evidence for a second state are as follows (well resolved dips for both ground and excited states in profiles) 10 13 15 18 22 25 26 27 28 29 33 37 38 39 41 42 43 44 45 48 50 51 52 53 54 55 56 59 60 61 63 64 65 66 67 68 69 ; _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 1 '2D 1H-15N HSQC' . . . 26520 2 2 '2D 1H-15N HMQC' . . . 26520 2 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 3 3 GLN N N 15 0.9 5.2 . . . . . . . 26520 2 2 . 1 1 5 5 ALA N N 15 0.3 4.3 . . . . . . . 26520 2 3 . 1 1 6 6 LYS N N 15 0.0 3.3 . . . . . . . 26520 2 4 . 1 1 7 7 LYS N N 15 0.5 3.7 . . . . . . . 26520 2 5 . 1 1 8 8 THR N N 15 7.9 2.9 . . . . . . . 26520 2 6 . 1 1 9 9 TYR N N 15 19.1 7.1 . . . . . . . 26520 2 7 . 1 1 10 10 THR N N 15 27.2 5.2 . . . . . . . 26520 2 8 . 1 1 11 11 TRP N N 15 42.5 18.4 . . . . . . . 26520 2 9 . 1 1 12 12 ASN N N 15 1.0 7.0 . . . . . . . 26520 2 10 . 1 1 13 13 THR N N 15 120.2 6.3 . . . . . . . 26520 2 11 . 1 1 14 14 LYS N N 15 14.6 8.8 . . . . . . . 26520 2 12 . 1 1 15 15 GLU N N 15 35.7 3.4 . . . . . . . 26520 2 13 . 1 1 16 16 GLU N N 15 26.0 4.8 . . . . . . . 26520 2 14 . 1 1 17 17 ALA N N 15 13.1 3.9 . . . . . . . 26520 2 15 . 1 1 18 18 LYS N N 15 39.3 4.3 . . . . . . . 26520 2 16 . 1 1 19 19 GLN N N 15 39.1 4.6 . . . . . . . 26520 2 17 . 1 1 20 20 ALA N N 15 66.5 33.9 . . . . . . . 26520 2 18 . 1 1 21 21 PHE N N 15 33.4 7.8 . . . . . . . 26520 2 19 . 1 1 22 22 LYS N N 15 75.1 5.4 . . . . . . . 26520 2 20 . 1 1 23 23 GLU N N 15 33.9 18.1 . . . . . . . 26520 2 21 . 1 1 24 24 LEU N N 15 28.6 10.9 . . . . . . . 26520 2 22 . 1 1 25 25 LEU N N 15 62.7 6.4 . . . . . . . 26520 2 23 . 1 1 26 26 LYS N N 15 92.9 5.9 . . . . . . . 26520 2 24 . 1 1 27 27 GLU N N 15 64.8 5.9 . . . . . . . 26520 2 25 . 1 1 28 28 LYS N N 15 204.9 11.4 . . . . . . . 26520 2 26 . 1 1 29 29 ARG N N 15 163.1 9.3 . . . . . . . 26520 2 27 . 1 1 30 30 VAL N N 15 88.2 6.8 . . . . . . . 26520 2 28 . 1 1 32 32 SER N N 15 28.4 6.2 . . . . . . . 26520 2 29 . 1 1 33 33 ASN N N 15 85.8 4.8 . . . . . . . 26520 2 30 . 1 1 34 34 ALA N N 15 17.8 2.8 . . . . . . . 26520 2 31 . 1 1 35 35 SER N N 15 28.4 3.9 . . . . . . . 26520 2 32 . 1 1 36 36 TRP N N 15 7.1 8.4 . . . . . . . 26520 2 33 . 1 1 37 37 GLU N N 15 100.7 6.3 . . . . . . . 26520 2 34 . 1 1 38 38 GLN N N 15 18.9 4.5 . . . . . . . 26520 2 35 . 1 1 39 39 ALA N N 15 30.1 4.5 . . . . . . . 26520 2 36 . 1 1 40 40 MET N N 15 14.6 4.7 . . . . . . . 26520 2 37 . 1 1 41 41 LYS N N 15 103.4 6.5 . . . . . . . 26520 2 38 . 1 1 42 42 MET N N 15 165.0 11.1 . . . . . . . 26520 2 39 . 1 1 43 43 ILE N N 15 217.1 14.6 . . . . . . . 26520 2 40 . 1 1 44 44 ILE N N 15 197.0 13.6 . . . . . . . 26520 2 41 . 1 1 45 45 ASN N N 15 161.9 7.4 . . . . . . . 26520 2 42 . 1 1 46 46 ASP N N 15 28.2 4.7 . . . . . . . 26520 2 43 . 1 1 48 48 ARG N N 15 29.0 4.2 . . . . . . . 26520 2 44 . 1 1 50 50 SER N N 15 70.1 4.7 . . . . . . . 26520 2 45 . 1 1 51 51 ALA N N 15 59.5 6.4 . . . . . . . 26520 2 46 . 1 1 52 52 LEU N N 15 21.9 8.6 . . . . . . . 26520 2 47 . 1 1 53 53 ALA N N 15 47.6 4.4 . . . . . . . 26520 2 48 . 1 1 54 54 LYS N N 15 69.5 3.8 . . . . . . . 26520 2 49 . 1 1 55 55 LEU N N 15 35.0 4.4 . . . . . . . 26520 2 50 . 1 1 56 56 SER N N 15 88.1 6.3 . . . . . . . 26520 2 51 . 1 1 57 57 GLU N N 15 38.2 7.2 . . . . . . . 26520 2 52 . 1 1 58 58 LYS N N 15 40.3 8.8 . . . . . . . 26520 2 53 . 1 1 59 59 LYS N N 15 38.5 5.9 . . . . . . . 26520 2 54 . 1 1 60 60 GLN N N 15 33.9 3.2 . . . . . . . 26520 2 55 . 1 1 61 61 ALA N N 15 18.8 3.4 . . . . . . . 26520 2 56 . 1 1 62 62 PHE N N 15 13.7 4.5 . . . . . . . 26520 2 57 . 1 1 63 63 ASN N N 15 39.9 4.0 . . . . . . . 26520 2 58 . 1 1 64 64 ALA N N 15 20.7 3.4 . . . . . . . 26520 2 59 . 1 1 65 65 TYR N N 15 21.7 4.3 . . . . . . . 26520 2 60 . 1 1 66 66 LYS N N 15 49.5 5.2 . . . . . . . 26520 2 61 . 1 1 67 67 VAL N N 15 62.0 3.8 . . . . . . . 26520 2 62 . 1 1 68 68 GLN N N 15 44.0 2.9 . . . . . . . 26520 2 63 . 1 1 69 69 THR N N 15 12.5 2.0 . . . . . . . 26520 2 64 . 1 1 70 70 GLU N N 15 3.1 1.6 . . . . . . . 26520 2 65 . 1 1 71 71 LYS N N 15 1.0 5.0 . . . . . . . 26520 2 stop_ save_