NMR Restraints Grid

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

image	mrblock_id	pdb_id	cing	stage	program	type
	4919	1g1p	cing	1-original	MR format	comment

*HEADER    TOXIN                                   13-OCT-00   1G1P              
*TITLE     NMR STRUCTURES OF THE NOVEL CONOTOXIN EVIA FROM CONUS                 
*TITLE    2 ERMINEUS SPECIFIC OF THE MU1 SODIUM CHANNEL RECEPTOR, LEU12-         
*TITLE    3 PRO13 TRANS ISOMER                                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CONOTOXIN EVIA;                                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 OTHER_DETAILS: THIS STRUCTURE IS IN EQUILIBRIUM WITH THE             
*COMPND   6 LEU12-PRO13 CIS ISOMER (1G1Z).                                       
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE SOLID PHASE SYNTHESIS OF CONOTOXIN EVIA           
*SOURCE   4 WAS CARRIED OUT USING THE F-MOC CHEMISTRY. THE SEQUENCE OF           
*SOURCE   5 THE PEPTIDE IS NATURALLY FOUND IN CONUS ERMINEUS (ATLANTIC           
*SOURCE   6 FISH-HUNTING CONE).                                                  
*KEYWDS    THREE DISULFIDE LINKAGES, CIS/TRANS ISOMERISM OF LEU12-               
*KEYWDS   2 PRO13 PEPTIDE BOND, HYDROXYPROLINE                                   
*EXPDTA    NMR, 18 STRUCTURES                                                    
*AUTHOR    L.VOLPON, H.LAMTHANH, F.LE GALL, A.MENEZ, J.M.LANCELIN                
*REVDAT   1   01-NOV-00 1G1P    0                                                
remarks   NOE restraints for Conotoxin EVIA
remarks   data from NOESY spectrum at 10C
remarks   r0      dlow      dhigh   for N-H
remarks   2.1      0.3        0.9   (1.8 - 3.0) noe fort
remarks   2.4      0.6        1.2   (1.8 - 3.6) noe moyen
remarks   2.9      1.1        2.4   (1.8 - 5.3) noe faible
remarks   2.9      1.1        3.4   (1.8 - 6.3) noe tres faible

remarks   r0      dlow      dhigh   for C-H
remarks   2.1      0.3        0.6   (1.8 - 2.7) strong noe
remarks   2.4      0.6        0.9   (1.8 - 3.3) medium noe
remarks   2.9      1.1        2.1   (1.8 - 5.0) weak noe
remarks   2.9      1.1        3.1   (1.8 - 6.0) very weak noe

remarks   1.0  added for noe involving methyl groups
remarks   1.0  added for noe involving CH2
remarks   2.0  added for noe involving aromatics hydrogens

remarks   NOE restraints for Asp1 residue

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