NMR Restraints Grid

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

image	mrblock_id	pdb_id	cing	stage	position	type
	28546	3cys	cing	1-original	1	comment

REMARK   1                                                              
REMARK   1 THIS FILE CONTAINS DATA THAT WAS USED IN THE DETERMINATION   
REMARK   1 OF THE THREE-DIMENSIONAL STRUCTURE OF THE COMPLEX OF 
REMARK   1 CYCLOPHILIN A - CYCLOSPORIN A  BY NMR IN SOLUTION.     
REMARK   2                                                              
REMARK   2                                                              
REMARK   2 THE DIFFERENT KINDS OF DATA TOGETHER WITH THE CORRESPONDING  
REMARK   2 RECORD IDENTIFIERS ARE GIVEN IN THE FOLLOWING TABLE.         
REMARK   2                                                              
REMARK   2 RECORD CONTENT                                     UNIT      
REMARK   2 ------ ------------------------------------------- --------- 
REMARK   2 SHIFTS CHEMICAL SHIFTS OF THE ASSIGNED PROTONS     PPM
REMARK   2        13 C AND 15 N RESONACES      
REMARK   2 JCOUPL VICINAL 1H-1H SCALAR COUPLING CONSTANTS     HERTZ     
REMARK   2 NOEUPP UPPER LIMITS FOR INTERATOMIC DISTANCES      ANGSTROMS 
REMARK   2        DETERMINED FROM NUCLEAR OVERHAUSER EFFECTS            
REMARK   2 ANGLE  TORSION ANGLE CONSTRAINTS IN THE FORM OF    DEGREES  
REMARK   2        AN ALLOWED INTERVAL                                   
REMARK   2                                                              
REMARK   2 THE NEXT TABLE CONTAINS A DETAILED DESCRIPTION OF THE        
REMARK   2 CONTENTS AND FORMATS OF THE VARIOUS DATA RECORDS AND THE     
REMARK   2 MASTER RECORD.                                               
REMARK   2                                                              
REMARK   2 RECORD CONTENTS (FORTRAN FORMAT)                             
REMARK   2 ------ ----------------------------------------------------- 
REMARK   2 SHIFTS RESIDUE NAME, RESIDUE NUMBER, ATOM NAME, CHEMICAL    
REMARK   2        SHIFT(S), ATOM NAME, CHEMICAL SHIFT(S), ATOM NAME,    
REMARK   2        CHEMICAL SHIFT(S)                                     
REMARK   2        ('SHIFTS',2X,A4,I4,2X,3(A4,2F6.2,2X))                 
REMARK   2 JCOUPL RESIDUE NAME, RESIDUE NUMBER, FIRST AND SECOND ATOM   
REMARK   2        NAME, J-COUPLING CONSTANT, FIRST AND SECOND ATOM      
REMARK   2        NAME, J-COUPLING CONSTANT, FIRST AND SECOND ATOM      
REMARK   2        NAME, J-COUPLING CONSTANT                             
REMARK   2        ('JCOUPL',2X,A4,I4,2X,3(A4,1X,A4,F6.2,3X))            
REMARK   2 NOEUPP FIRST RESIDUE NAME, FIRST RESIDUE NUMBER, FIRST ATOM  
REMARK   2        NAME, SECOND RESIDUE NAME, SECOND RESIDUE NUMBER,     
REMARK   2        SECOND ATOM NAME, UPPER DISTANCE LIMIT, FIRST ATOM    
REMARK   2        NAME, SECOND RESIDUE NAME, SECOND RESIDUE NUMBER,     
REMARK   2        SECOND ATOM NAME, UPPER DISTANCE LIMIT                
REMARK   2        ('NOEUPP',2X,A4,I4,1X,2(A4,1X,A4,I4,1X,A4,F6.2,5X))   
REMARK   2 ANGLE  RESIDUE NAME, RESIDUE NUMBER, ANGLE NAME, LOWER AND   
REMARK   2        UPPER BOUND, ANGLE NAME, LOWER AND UPPER BOUND       
REMARK   2        ('ANGLE',3X,A4,I4,1X,2(A5,2F8.2,8X))
REMARK   3 PROTON CHEMICAL SHIFTS                 

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