NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id cing in_recoord stage program type
34752 1kbs cing recoord 2-parsed STAR comment 

data_1kbs_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1kbs 
    _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_1kbs   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1kbs 
    _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   1kbs   "Master copy"    parsed_1kbs   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1kbs 
    _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   1kbs.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_1kbs   1   
        1   1kbs.mr   .   .    XPLOR/CNS     2    distance                 "disulfide bond"     simple               4   parsed_1kbs   1   
        1   1kbs.mr   .   .    XPLOR/CNS     3    distance                  NOE                 simple             113   parsed_1kbs   1   
        1   1kbs.mr   .   .    XPLOR/CNS     4    distance                 "hydrogen bond"      simple              28   parsed_1kbs   1   
        1   1kbs.mr   .   .    XPLOR/CNS     5    distance                  NOE                 simple             275   parsed_1kbs   1   
        1   1kbs.mr   .   .    n/a           6    comment                  "Not applicable"    "Not applicable"      0   parsed_1kbs   1   
        1   1kbs.mr   .   .    XPLOR/CNS     7   "dihedral angle"          "Not applicable"    "Not applicable"      0   parsed_1kbs   1   
        1   1kbs.mr   .   .    n/a           8    comment                  "Not applicable"    "Not applicable"      0   parsed_1kbs   1   
        1   1kbs.mr   .   .   "MR format"    9   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_1kbs   1   
    stop_

save_


save_MR_file_comment_6
    _Org_constr_file_comment.Sf_category         org_constr_file_comment 
    _Org_constr_file_comment.Entry_ID            parsed_1kbs 
    _Org_constr_file_comment.ID                  1 
    _Org_constr_file_comment.Constraint_file_ID  1 
    _Org_constr_file_comment.Block_ID            6 
    _Org_constr_file_comment.Details            "Generated by Wattos" 
    _Org_constr_file_comment.Comment            
;
set message=on echo=on end

From root  Mon Jul 22 07:20:13 1996
Received: by pdb.pdb.bnl.gov (950511.SGI.8.6.12.PATCH526/940406.SGI)
	for bailey@pdb.pdb.bnl.gov id HAA23168; Mon, 22 Jul 1996 07:20:13 -0400
Date: Mon, 22 Jul 1996 07:20:13 -0400
From: root (Super-User)
Message-Id: <199607221120.HAA23168@pdb.pdb.bnl.gov>
To: bailey
Subject: from ftp: ctx4dih-3.tbl
Status: Op

REMARK	THIS FILE CONTAINS THE INPUT DIHEDRAL ANGLE CONSTRAINTS USED TO
REMARK	TO DERIVE THE NMR SOLUTION STRUCTURE OF THE CYTOTOXIN,
REMARK	CTX IV, FROM THE TAIWAN COBRA (NAJA NAJA ATRA) VENOM
REMARK	DEPOSITION FORM FILE NAME - ctx4_dep_form. txt
 
!set message=off echo=off end
cons dihedral reset
;

save_

Please acknowledge these references in publications where the data from this site have been utilized.

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