NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage program type
14317 1wjk 10060 cing 1-original MR format comment


*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   29-MAY-04   1WJK              
*TITLE     SOLUTION STRUCTURE OF HYPOTHETICAL PROTEIN C330018D20RIK              
*TITLE    2 FROM MUS MUSCULUS                                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: C330018D20RIK PROTEIN;                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: GLUTAREDOXIN DOMAIN;                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: HOUSE MOUSE;                                        
*SOURCE   4 ORGANISM_TAXID: 10090;                                               
*SOURCE   5 GENE: RIKEN CDNA C330018D20;                                         
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P031125-30;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    GLUTAREDOXIN, THIOREDOXIN FOLD, STRUCTURAL GENOMICS, RIKEN            
*KEYWDS   2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI, UNKNOWN             
*KEYWDS   3 FUNCTION                                                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.SATO, S.KOSHIBA, M.INOUE, T.KIGAWA, S.YOKOYAMA, RIKEN               
*AUTHOR   2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)                     
*REVDAT   1   12-MAY-09 1WJK    0                                                

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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.
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