NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type |
40153 | 1ujt | 10102 | cing | 2-parsed | STAR | comment |
data_1ujt_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1ujt _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project" NMR . parsed_1ujt 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1ujt _Entry.Title "Original constraint list(s)" _Entry.Version_type original _Entry.Submission_date . _Entry.Accession_date . _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination . _Entry.NMR_STAR_version 3.1 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1ujt "Master copy" parsed_1ujt stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1ujt _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 1ujt.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1ujt 1 1 1ujt.mr . . DYANA/DIANA 2 distance NOE simple 0 parsed_1ujt 1 1 1ujt.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 0 parsed_1ujt 1 1 1ujt.mr . . DYANA/DIANA 4 distance NOE simple 0 parsed_1ujt 1 1 1ujt.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1ujt 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1ujt _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; *HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 11-AUG-03 1UJT *TITLE SOLUTION STRUCTURE OF THE SECOND FIBRONECTIN TYPE III *TITLE 2 DOMAIN OF HUMAN KIAA1568 PROTEIN *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: KIAA1568 PROTEIN; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: FN3 DOMAIN; *COMPND 5 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; *SOURCE 3 ORGANISM_COMMON: HUMAN; *SOURCE 4 ORGANISM_TAXID: 9606; *SOURCE 5 GENE: KAZUSA CDNA FH22308; *SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; *SOURCE 7 EXPRESSION_SYSTEM_PLASMID: P021007-59; *SOURCE 8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS *KEYWDS FIBRONECTIN TYPE III DOMAIN, STRUCTURAL GENOMICS, RIKEN *KEYWDS 2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI, UNKNOWN *KEYWDS 3 FUNCTION *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR N.TOCHIO, S.KOSHIBA, T.KIGAWA, S.YOKOYAMA, RIKEN STRUCTURAL *AUTHOR 2 GENOMICS/PROTEOMICS INITIATIVE (RSGI) *REVDAT 1 12-MAY-09 1UJT 0 ************************************************************** During the CYANA calculations automatic implicit swapping of restraints involving diastereotopic substitutents was applied for prochrial groups without stereospecific assignment. Diastereotopic substitents were swapped individually in each conformer to calculate the minimal target function and restraint violations. The optimal swapping for a given prochiral group may differ among the 20 conformers that represent the solution structure. The swapping is therefore performed implicitly in the program and is not reflected in the distance restraint file deposited in the PDB. ************************************************************** ; save_
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