NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id bmrb_id cing in_recoord stage program type
33213 1hvw 4937 cing recoord 2-parsed STAR comment 

data_1hvw_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1hvw 
    _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_1hvw   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1hvw 
    _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   1hvw   "Master copy"    parsed_1hvw   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1hvw 
    _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   1hvw.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_1hvw   1   
        1   1hvw.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             0   parsed_1hvw   1   
        1   1hvw.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple             0   parsed_1hvw   1   
        1   1hvw.mr   .   .    XPLOR/CNS     4   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_1hvw   1   
        1   1hvw.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_1hvw   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_1hvw 
    _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    TOXIN                                   08-JAN-01   1HVW              
*TITLE     HAIRPINLESS MUTANT OF OMEGA-ATRACOTOXIN-HV1A                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: OMEGA-ATRACOTOXIN-HV1A;                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: OMEGA-ACTX-HV1A;                                            
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THIS PEPTIDE WAS CHEMICALLY SYNTHESIZED.              
*SOURCE   4 THE NATIVE PEPTIDE IS NATURALLY FOUND IN HADRONYCHE                  
*SOURCE   5 VERSUTA (BLUE MOUNTAIN FUNNEL-WEB SPIDER).THE MUTANT                 
*SOURCE   6 HAIRPINLESS TOXIN WAS SYNTHESIZED BY SOLID-PHASE PEPTIDE             
*SOURCE   7 SYNTHESIS, OXIDIZED/FOLDED IN A GLUTATHIONE REDOX BUFFER,            
*SOURCE   8 THEN PURIFIED USING REVERSE-PHASE HPLC.                              
*KEYWDS    CYSTINE KNOT, BETA-HAIRPIN                                            
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.I.FLETCHER, G.F.KING                                                
*REVDAT   1   17-JAN-01 1HVW    0                                                
;

save_

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