data_19767 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19767 _Entry.Title ; Solid-state NMR assignment of metal-free SOD1 fibrillar structures ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-02-05 _Entry.Accession_date 2014-02-05 _Entry.Last_release_date 2014-06-05 _Entry.Original_release_date 2014-06-05 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLID-STATE _Entry.Details 'In this construct residues 49 81 and 124 139 of SOD1 were replaced with a short Gly-Ala-Gly tripeptide linkers.' _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 Lucia Banci . . . 19767 2 Olga Blazevits . . . 19767 3 Francesca Cantini . . . 19767 4 Jens Danielsson . . . 19767 5 Lisa Lang . . . 19767 6 Claudio Luchinat . . . 19767 7 Jiafei Mao . . . 19767 8 Mikael Oliveberg . . . 19767 9 Enrico Ravera . . . 19767 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19767 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 79 19767 '15N chemical shifts' 28 19767 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 . . 2014-06-05 2014-02-05 original author . 19767 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19767 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24719206 _Citation.Full_citation . _Citation.Title 'Solid-state NMR studies of metal-free SOD1 fibrillar structures.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Inorg. Chem.' _Citation.Journal_name_full 'Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry' _Citation.Journal_volume 19 _Citation.Journal_issue 4-5 _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 659 _Citation.Page_last 666 _Citation.Year 2014 _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 Lucia Banci . . . 19767 1 2 Olga Blaevit . . . 19767 1 3 Francesca Cantini . . . 19767 1 4 Jens Danielsson . . . 19767 1 5 Lisa Lang . . . 19767 1 6 Claudio Luchinat . . . 19767 1 7 Jiafei Mao . . . 19767 1 8 Mikael Oliveberg . . . 19767 1 9 Enrico Ravera . . . 19767 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID ALS 19767 1 FIBRILS 19767 1 SOD1 19767 1 'SOLID STATE NMR' 19767 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19767 _Assembly.ID 1 _Assembly.Name fibrils _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 'fibrils of apoSOD1-DeltaIV-VII' _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 apoSOD1-DeltaIV-VII 1 $apoSOD1-DeltaIV-VII A . yes na no no . . . 19767 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_apoSOD1-DeltaIV-VII _Entity.Sf_category entity _Entity.Sf_framecode apoSOD1-DeltaIV-VII _Entity.Entry_ID 19767 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name apoSOD1-DeltaIV-VII _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 ; ATKAVAVLKGDGPVQGIINF EQKESNGPVKVWGSIKGLTE GLHGFHVHGAGGDLGNVTAD KDGVADVSIEDSVISLSGDH SIIGRTLVVHEKAGAGAGSR LASGVIGIAQ ; _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 110 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation C6A/C111S/C146S _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 PDB 4BCZ . "Monomeric Human Cu,zn Superoxide Dismutase, Loops Iv And Vii Deleted, Apo Form" . . . . . 100.00 110 100.00 100.00 1.37e-67 . . . . 19767 1 2 no PDB 4BD4 . "Monomeric Human Cu,zn Superoxide Dismutase, Loops Iv And Vii Deleted, Apo Form, Mutant H43f" . . . . . 100.00 110 99.09 99.09 1.54e-66 . . . . 19767 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 ALA . 19767 1 2 2 THR . 19767 1 3 3 LYS . 19767 1 4 4 ALA . 19767 1 5 5 VAL . 19767 1 6 6 ALA . 19767 1 7 7 VAL . 19767 1 8 8 LEU . 19767 1 9 9 LYS . 19767 1 10 10 GLY . 19767 1 11 11 ASP . 19767 1 12 12 GLY . 19767 1 13 13 PRO . 19767 1 14 14 VAL . 19767 1 15 15 GLN . 19767 1 16 16 GLY . 19767 1 17 17 ILE . 19767 1 18 18 ILE . 19767 1 19 19 ASN . 19767 1 20 20 PHE . 19767 1 21 21 GLU . 19767 1 22 22 GLN . 19767 1 23 23 LYS . 19767 1 24 24 GLU . 19767 1 25 25 SER . 19767 1 26 26 ASN . 19767 1 27 27 GLY . 19767 1 28 28 PRO . 19767 1 29 29 VAL . 19767 1 30 30 LYS . 19767 1 31 31 VAL . 19767 1 32 32 TRP . 19767 1 33 33 GLY . 19767 1 34 34 SER . 19767 1 35 35 ILE . 19767 1 36 36 LYS . 19767 1 37 37 GLY . 19767 1 38 38 LEU . 19767 1 39 39 THR . 19767 1 40 40 GLU . 19767 1 41 41 GLY . 19767 1 42 42 LEU . 19767 1 43 43 HIS . 19767 1 44 44 GLY . 19767 1 45 45 PHE . 19767 1 46 46 HIS . 19767 1 47 47 VAL . 19767 1 48 48 HIS . 19767 1 49 49 GLY . 19767 1 50 50 ALA . 19767 1 51 51 GLY . 19767 1 52 52 GLY . 19767 1 53 53 ASP . 19767 1 54 54 LEU . 19767 1 55 55 GLY . 19767 1 56 56 ASN . 19767 1 57 57 VAL . 19767 1 58 58 THR . 19767 1 59 59 ALA . 19767 1 60 60 ASP . 19767 1 61 61 LYS . 19767 1 62 62 ASP . 19767 1 63 63 GLY . 19767 1 64 64 VAL . 19767 1 65 65 ALA . 19767 1 66 66 ASP . 19767 1 67 67 VAL . 19767 1 68 68 SER . 19767 1 69 69 ILE . 19767 1 70 70 GLU . 19767 1 71 71 ASP . 19767 1 72 72 SER . 19767 1 73 73 VAL . 19767 1 74 74 ILE . 19767 1 75 75 SER . 19767 1 76 76 LEU . 19767 1 77 77 SER . 19767 1 78 78 GLY . 19767 1 79 79 ASP . 19767 1 80 80 HIS . 19767 1 81 81 SER . 19767 1 82 82 ILE . 19767 1 83 83 ILE . 19767 1 84 84 GLY . 19767 1 85 85 ARG . 19767 1 86 86 THR . 19767 1 87 87 LEU . 19767 1 88 88 VAL . 19767 1 89 89 VAL . 19767 1 90 90 HIS . 19767 1 91 91 GLU . 19767 1 92 92 LYS . 19767 1 93 93 ALA . 19767 1 94 94 GLY . 19767 1 95 95 ALA . 19767 1 96 96 GLY . 19767 1 97 97 ALA . 19767 1 98 98 GLY . 19767 1 99 99 SER . 19767 1 100 100 ARG . 19767 1 101 101 LEU . 19767 1 102 102 ALA . 19767 1 103 103 SER . 19767 1 104 104 GLY . 19767 1 105 105 VAL . 19767 1 106 106 ILE . 19767 1 107 107 GLY . 19767 1 108 108 ILE . 19767 1 109 109 ALA . 19767 1 110 110 GLN . 19767 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 . ALA 1 1 19767 1 . THR 2 2 19767 1 . LYS 3 3 19767 1 . ALA 4 4 19767 1 . VAL 5 5 19767 1 . ALA 6 6 19767 1 . VAL 7 7 19767 1 . LEU 8 8 19767 1 . LYS 9 9 19767 1 . GLY 10 10 19767 1 . ASP 11 11 19767 1 . GLY 12 12 19767 1 . PRO 13 13 19767 1 . VAL 14 14 19767 1 . GLN 15 15 19767 1 . GLY 16 16 19767 1 . ILE 17 17 19767 1 . ILE 18 18 19767 1 . ASN 19 19 19767 1 . PHE 20 20 19767 1 . GLU 21 21 19767 1 . GLN 22 22 19767 1 . LYS 23 23 19767 1 . GLU 24 24 19767 1 . SER 25 25 19767 1 . ASN 26 26 19767 1 . GLY 27 27 19767 1 . PRO 28 28 19767 1 . VAL 29 29 19767 1 . LYS 30 30 19767 1 . VAL 31 31 19767 1 . TRP 32 32 19767 1 . GLY 33 33 19767 1 . SER 34 34 19767 1 . ILE 35 35 19767 1 . LYS 36 36 19767 1 . GLY 37 37 19767 1 . LEU 38 38 19767 1 . THR 39 39 19767 1 . GLU 40 40 19767 1 . GLY 41 41 19767 1 . LEU 42 42 19767 1 . HIS 43 43 19767 1 . GLY 44 44 19767 1 . PHE 45 45 19767 1 . HIS 46 46 19767 1 . VAL 47 47 19767 1 . HIS 48 48 19767 1 . GLY 49 49 19767 1 . ALA 50 50 19767 1 . GLY 51 51 19767 1 . GLY 52 52 19767 1 . ASP 53 53 19767 1 . LEU 54 54 19767 1 . GLY 55 55 19767 1 . ASN 56 56 19767 1 . VAL 57 57 19767 1 . THR 58 58 19767 1 . ALA 59 59 19767 1 . ASP 60 60 19767 1 . LYS 61 61 19767 1 . ASP 62 62 19767 1 . GLY 63 63 19767 1 . VAL 64 64 19767 1 . ALA 65 65 19767 1 . ASP 66 66 19767 1 . VAL 67 67 19767 1 . SER 68 68 19767 1 . ILE 69 69 19767 1 . GLU 70 70 19767 1 . ASP 71 71 19767 1 . SER 72 72 19767 1 . VAL 73 73 19767 1 . ILE 74 74 19767 1 . SER 75 75 19767 1 . LEU 76 76 19767 1 . SER 77 77 19767 1 . GLY 78 78 19767 1 . ASP 79 79 19767 1 . HIS 80 80 19767 1 . SER 81 81 19767 1 . ILE 82 82 19767 1 . ILE 83 83 19767 1 . GLY 84 84 19767 1 . ARG 85 85 19767 1 . THR 86 86 19767 1 . LEU 87 87 19767 1 . VAL 88 88 19767 1 . VAL 89 89 19767 1 . HIS 90 90 19767 1 . GLU 91 91 19767 1 . LYS 92 92 19767 1 . ALA 93 93 19767 1 . GLY 94 94 19767 1 . ALA 95 95 19767 1 . GLY 96 96 19767 1 . ALA 97 97 19767 1 . GLY 98 98 19767 1 . SER 99 99 19767 1 . ARG 100 100 19767 1 . LEU 101 101 19767 1 . ALA 102 102 19767 1 . SER 103 103 19767 1 . GLY 104 104 19767 1 . VAL 105 105 19767 1 . ILE 106 106 19767 1 . GLY 107 107 19767 1 . ILE 108 108 19767 1 . ALA 109 109 19767 1 . GLN 110 110 19767 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 19767 _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 $apoSOD1-DeltaIV-VII . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19767 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 19767 _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 $apoSOD1-DeltaIV-VII . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli Origami pLysS . . . . . . . . . . . . . . pET3a . . . . . . 19767 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19767 _Sample.ID 1 _Sample.Type fiber _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 apoSOD1-DeltaIV-VII '[U-13C; U-15N]' . . . . . . na . . na . . . . 19767 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 19767 _Sample_condition_list.ID 1 _Sample_condition_list.Details 'SOD1(IV-VII) fibrils were prepared diluting freshly prepared 13C-15N SOD1(IV-VII) at 200-230 M concentration in 10mM Bis-Tris, pH 6.2 up to the final volume of 10 ml. The obtained solution was incubated at 37 C for 4 days with shaking at 1200 rpm in order to get well mature fibrils' 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 6.2 . pH 19767 1 pressure 1 . atm 19767 1 temperature 298 . K 19767 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 19767 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 19767 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 19767 1 processing 19767 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 19767 _Software.ID 2 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 19767 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19767 2 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 19767 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'wide-bore instrument operating at 20.0 T' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 19767 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 19767 _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 Bruker Avance . 850 'wide-bore instrument operating at 20.0 T' . . 19767 1 2 spectrometer_2 Bruker Avance . 700 . . . 19767 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 19767 _Experiment_list.ID 1 _Experiment_list.Details 'The MAS frequency was set to 14 kHz and a 1H SWTPPM decoupling of 75 kHz was applied in all the evolution delays' 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 DARR' no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19767 1 2 '2D NCA' no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19767 1 3 '2D NCO' no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19767 1 4 '3D NCACX' no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19767 1 5 '3D NCOCX' no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19767 1 6 '1H-13C INEPT-HETCOR' no . . . . . . . . . . 1 $sample_1 solid . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19767 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 19767 _Chem_shift_reference.ID 1 _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TSP 'methyl carbons' . . . . ppm 0 external direct 1 . . . . . . . . . 19767 1 N 15 '[15N] ammonium chloride' nitrogen . . . . ppm 32.5 external direct 1 . . . . . . . . . 19767 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 19767 _Assigned_chem_shift_list.ID 1 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.5 _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 2 '2D NCA' . . . 19767 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 19 19 ASN C C 13 177.114 0.3 . 1 . . . . 19 ASN C . 19767 1 2 . 1 1 19 19 ASN CA C 13 53.005 0.3 . 1 . . . . 19 ASN CA . 19767 1 3 . 1 1 19 19 ASN CB C 13 38.672 0.3 . 1 . . . . 19 ASN CB . 19767 1 4 . 1 1 19 19 ASN N N 15 114.809 0.3 . 1 . . . . 19 ASN N . 19767 1 5 . 1 1 20 20 PHE C C 13 173.384 0.3 . 1 . . . . 20 PHE C . 19767 1 6 . 1 1 20 20 PHE CA C 13 57.185 0.3 . 1 . . . . 20 PHE CA . 19767 1 7 . 1 1 20 20 PHE CB C 13 42.296 0.3 . 1 . . . . 20 PHE CB . 19767 1 8 . 1 1 20 20 PHE N N 15 126.203 0.3 . 1 . . . . 20 PHE N . 19767 1 9 . 1 1 21 21 GLU C C 13 174.830 0.3 . 1 . . . . 21 GLU C . 19767 1 10 . 1 1 21 21 GLU CA C 13 54.722 0.3 . 1 . . . . 21 GLU CA . 19767 1 11 . 1 1 21 21 GLU CB C 13 33.756 0.3 . 1 . . . . 21 GLU CB . 19767 1 12 . 1 1 21 21 GLU N N 15 131.884 0.3 . 1 . . . . 21 GLU N . 19767 1 13 . 1 1 28 28 PRO C C 13 176.207 0.3 . 1 . . . . 28 PRO C . 19767 1 14 . 1 1 28 28 PRO CA C 13 62.646 0.3 . 1 . . . . 28 PRO CA . 19767 1 15 . 1 1 28 28 PRO CB C 13 31.863 0.3 . 1 . . . . 28 PRO CB . 19767 1 16 . 1 1 29 29 VAL CA C 13 60.655 0.3 . 1 . . . . 29 VAL CA . 19767 1 17 . 1 1 29 29 VAL CB C 13 35.545 0.3 . 1 . . . . 29 VAL CB . 19767 1 18 . 1 1 29 29 VAL N N 15 124.011 0.3 . 1 . . . . 29 VAL N . 19767 1 19 . 1 1 33 33 GLY C C 13 171.987 0.3 . 1 . . . . 33 GLY C . 19767 1 20 . 1 1 33 33 GLY CA C 13 48.172 0.3 . 1 . . . . 33 GLY CA . 19767 1 21 . 1 1 33 33 GLY N N 15 120.977 0.3 . 1 . . . . 33 GLY N . 19767 1 22 . 1 1 34 34 SER C C 13 172.188 0.3 . 1 . . . . 34 SER C . 19767 1 23 . 1 1 34 34 SER CA C 13 57.334 0.3 . 1 . . . . 34 SER CA . 19767 1 24 . 1 1 34 34 SER CB C 13 67.579 0.3 . 1 . . . . 34 SER CB . 19767 1 25 . 1 1 34 34 SER N N 15 108.581 0.3 . 1 . . . . 34 SER N . 19767 1 26 . 1 1 35 35 ILE C C 13 175.215 0.3 . 1 . . . . 35 ILE C . 19767 1 27 . 1 1 35 35 ILE CA C 13 60.083 0.3 . 1 . . . . 35 ILE CA . 19767 1 28 . 1 1 35 35 ILE CB C 13 42.132 0.3 . 1 . . . . 35 ILE CB . 19767 1 29 . 1 1 35 35 ILE N N 15 120.180 0.3 . 1 . . . . 35 ILE N . 19767 1 30 . 1 1 36 36 LYS C C 13 175.185 0.3 . 1 . . . . 36 LYS C . 19767 1 31 . 1 1 36 36 LYS CA C 13 54.764 0.3 . 1 . . . . 36 LYS CA . 19767 1 32 . 1 1 36 36 LYS CB C 13 35.757 0.3 . 1 . . . . 36 LYS CB . 19767 1 33 . 1 1 36 36 LYS N N 15 128.600 0.3 . 1 . . . . 36 LYS N . 19767 1 34 . 1 1 37 37 GLY C C 13 171.180 0.3 . 1 . . . . 37 GLY C . 19767 1 35 . 1 1 37 37 GLY CA C 13 45.078 0.3 . 1 . . . . 37 GLY CA . 19767 1 36 . 1 1 37 37 GLY N N 15 114.660 0.3 . 1 . . . . 37 GLY N . 19767 1 37 . 1 1 38 38 LEU C C 13 174.072 0.3 . 1 . . . . 38 LEU C . 19767 1 38 . 1 1 38 38 LEU CA C 13 53.930 0.3 . 1 . . . . 38 LEU CA . 19767 1 39 . 1 1 38 38 LEU CB C 13 44.264 0.3 . 1 . . . . 38 LEU CB . 19767 1 40 . 1 1 38 38 LEU N N 15 133.718 0.3 . 1 . . . . 38 LEU N . 19767 1 41 . 1 1 39 39 THR C C 13 174.243 0.3 . 1 . . . . 39 THR C . 19767 1 42 . 1 1 39 39 THR CA C 13 60.794 0.3 . 1 . . . . 39 THR CA . 19767 1 43 . 1 1 39 39 THR CB C 13 68.838 0.3 . 1 . . . . 39 THR CB . 19767 1 44 . 1 1 39 39 THR N N 15 124.170 0.3 . 1 . . . . 39 THR N . 19767 1 45 . 1 1 40 40 GLU C C 13 176.430 0.3 . 1 . . . . 40 GLU C . 19767 1 46 . 1 1 40 40 GLU CA C 13 57.224 0.3 . 1 . . . . 40 GLU CA . 19767 1 47 . 1 1 40 40 GLU CB C 13 30.758 0.3 . 1 . . . . 40 GLU CB . 19767 1 48 . 1 1 40 40 GLU N N 15 125.270 0.3 . 1 . . . . 40 GLU N . 19767 1 49 . 1 1 45 45 PHE CA C 13 57.306 0.3 . 1 . . . . 45 PHE CA . 19767 1 50 . 1 1 45 45 PHE CB C 13 42.717 0.3 . 1 . . . . 45 PHE CB . 19767 1 51 . 1 1 45 45 PHE N N 15 126.173 0.3 . 1 . . . . 45 PHE N . 19767 1 52 . 1 1 50 50 ALA C C 13 176.247 0.3 . 1 . . . . 50 ALA C . 19767 1 53 . 1 1 50 50 ALA CA C 13 53.468 0.3 . 1 . . . . 50 ALA CA . 19767 1 54 . 1 1 50 50 ALA N N 15 128.458 0.3 . 1 . . . . 50 ALA N . 19767 1 55 . 1 1 51 51 GLY C C 13 171.603 0.3 . 1 . . . . 51 GLY C . 19767 1 56 . 1 1 51 51 GLY CA C 13 48.585 0.3 . 1 . . . . 51 GLY CA . 19767 1 57 . 1 1 51 51 GLY N N 15 113.646 0.3 . 1 . . . . 51 GLY N . 19767 1 58 . 1 1 52 52 GLY C C 13 173.102 0.3 . 1 . . . . 52 GLY C . 19767 1 59 . 1 1 52 52 GLY CA C 13 46.894 0.3 . 1 . . . . 52 GLY CA . 19767 1 60 . 1 1 52 52 GLY N N 15 115.100 0.3 . 1 . . . . 52 GLY N . 19767 1 61 . 1 1 58 58 THR C C 13 172.107 0.3 . 1 . . . . 58 THR C . 19767 1 62 . 1 1 58 58 THR CA C 13 60.882 0.3 . 1 . . . . 58 THR CA . 19767 1 63 . 1 1 58 58 THR CB C 13 71.437 0.3 . 1 . . . . 58 THR CB . 19767 1 64 . 1 1 58 58 THR N N 15 122.404 0.3 . 1 . . . . 58 THR N . 19767 1 65 . 1 1 59 59 ALA C C 13 174.615 0.3 . 1 . . . . 59 ALA C . 19767 1 66 . 1 1 59 59 ALA CA C 13 49.948 0.3 . 1 . . . . 59 ALA CA . 19767 1 67 . 1 1 59 59 ALA CB C 13 21.477 0.3 . 1 . . . . 59 ALA CB . 19767 1 68 . 1 1 59 59 ALA N N 15 129.563 0.3 . 1 . . . . 59 ALA N . 19767 1 69 . 1 1 62 62 ASP C C 13 174.490 0.3 . 1 . . . . 62 ASP C . 19767 1 70 . 1 1 62 62 ASP CA C 13 57.024 0.3 . 1 . . . . 62 ASP CA . 19767 1 71 . 1 1 62 62 ASP CB C 13 39.853 0.3 . 1 . . . . 62 ASP CB . 19767 1 72 . 1 1 63 63 GLY C C 13 171.036 0.3 . 1 . . . . 63 GLY C . 19767 1 73 . 1 1 63 63 GLY CA C 13 44.721 0.3 . 1 . . . . 63 GLY CA . 19767 1 74 . 1 1 63 63 GLY N N 15 110.047 0.3 . 1 . . . . 63 GLY N . 19767 1 75 . 1 1 64 64 VAL C C 13 173.289 0.3 . 1 . . . . 64 VAL C . 19767 1 76 . 1 1 64 64 VAL CA C 13 60.722 0.3 . 1 . . . . 64 VAL CA . 19767 1 77 . 1 1 64 64 VAL CB C 13 35.315 0.3 . 1 . . . . 64 VAL CB . 19767 1 78 . 1 1 64 64 VAL N N 15 122.790 0.3 . 1 . . . . 64 VAL N . 19767 1 79 . 1 1 65 65 ALA CB C 13 22.130 0.3 . 1 . . . . 65 ALA CB . 19767 1 80 . 1 1 65 65 ALA N N 15 127.997 0.3 . 1 . . . . 65 ALA N . 19767 1 81 . 1 1 77 77 SER C C 13 171.254 0.3 . 1 . . . . 77 SER C . 19767 1 82 . 1 1 77 77 SER CA C 13 55.407 0.3 . 1 . . . . 77 SER CA . 19767 1 83 . 1 1 77 77 SER CB C 13 63.407 0.3 . 1 . . . . 77 SER CB . 19767 1 84 . 1 1 77 77 SER N N 15 125.500 0.3 . 1 . . . . 77 SER N . 19767 1 85 . 1 1 78 78 GLY C C 13 171.303 0.3 . 1 . . . . 78 GLY C . 19767 1 86 . 1 1 78 78 GLY CA C 13 44.034 0.3 . 1 . . . . 78 GLY CA . 19767 1 87 . 1 1 78 78 GLY N N 15 116.309 0.3 . 1 . . . . 78 GLY N . 19767 1 88 . 1 1 79 79 ASP C C 13 176.113 0.3 . 1 . . . . 79 ASP C . 19767 1 89 . 1 1 79 79 ASP CA C 13 51.223 0.3 . 1 . . . . 79 ASP CA . 19767 1 90 . 1 1 79 79 ASP CB C 13 41.896 0.3 . 1 . . . . 79 ASP CB . 19767 1 91 . 1 1 79 79 ASP N N 15 119.442 0.3 . 1 . . . . 79 ASP N . 19767 1 92 . 1 1 80 80 HIS C C 13 174.830 0.3 . 1 . . . . 80 HIS C . 19767 1 93 . 1 1 80 80 HIS CA C 13 56.729 0.3 . 1 . . . . 80 HIS CA . 19767 1 94 . 1 1 80 80 HIS CB C 13 25.359 0.3 . 1 . . . . 80 HIS CB . 19767 1 95 . 1 1 80 80 HIS N N 15 110.906 0.3 . 1 . . . . 80 HIS N . 19767 1 96 . 1 1 81 81 SER C C 13 173.140 0.3 . 1 . . . . 81 SER C . 19767 1 97 . 1 1 81 81 SER CA C 13 57.928 0.3 . 1 . . . . 81 SER CA . 19767 1 98 . 1 1 81 81 SER CB C 13 67.415 0.3 . 1 . . . . 81 SER CB . 19767 1 99 . 1 1 81 81 SER N N 15 118.278 0.3 . 1 . . . . 81 SER N . 19767 1 100 . 1 1 82 82 ILE C C 13 175.454 0.3 . 1 . . . . 82 ILE C . 19767 1 101 . 1 1 82 82 ILE CA C 13 60.671 0.3 . 1 . . . . 82 ILE CA . 19767 1 102 . 1 1 82 82 ILE CB C 13 36.393 0.3 . 1 . . . . 82 ILE CB . 19767 1 103 . 1 1 82 82 ILE N N 15 121.532 0.3 . 1 . . . . 82 ILE N . 19767 1 104 . 1 1 83 83 ILE C C 13 174.407 0.3 . 1 . . . . 83 ILE C . 19767 1 105 . 1 1 83 83 ILE CA C 13 61.147 0.3 . 1 . . . . 83 ILE CA . 19767 1 106 . 1 1 83 83 ILE CB C 13 36.487 0.3 . 1 . . . . 83 ILE CB . 19767 1 107 . 1 1 83 83 ILE N N 15 124.051 0.3 . 1 . . . . 83 ILE N . 19767 1 stop_ save_