NMR Restraints Grid

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

image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype	subsubtype
	24950	2k5t	cing	1-original	1	XPLOR/CNS	distance	hydrogen bond	simple

 remarks combinded restraints ET106 (E. coli YhhK) w/bound CoA

 remarks intermolecular distance and hbonds
 
 REMARKS hbond restraint to anchor COA pantothenyl 9 C=O to V68 NH
 assign (resid 68   and name HN    )(resid 999 and  name O9P ) 1.7 0.0 0.7
 assign (resid 68   and name N     )(resid 999 and  name O9P ) 2.7 0.0 0.7
 
 REMARKS hbond restraint to anchor COA pantothenyl 4 NH to L66 C=O
 assign (resid 66   and name O     )(resid 999 and  name HN4 ) 1.7 0.0 0.7
 assign (resid 66   and name O     )(resid 999 and  name N4P ) 2.7 0.0 0.7
 
 REMARKS hbond restraint R74 HN to COA O4A (phosphate O)
 assign (resid 74   and name HN    )(resid 999 and  name O4A ) 1.7 0.0 0.7
 assign (resid 74   and name N     )(resid 999 and  name O4A ) 2.7 0.0 0.7

 REMARKS hbond restraint R75 HN (slow exch) to COA O2A (phosphate O)
 assign (resid 75   and name HN    )(resid 999 and  name O2A ) 1.7 0.0 0.7
 assign (resid 75   and name N     )(resid 999 and  name O2A ) 2.7 0.0 0.7

 REMARKS hbond restraint G76 HN (slow exch) to COA O2A (phosphate O)
 assign (resid 76   and name HN    )(resid 999 and  name O2A ) 1.7 0.0 0.7
 assign (resid 76   and name N     )(resid 999 and  name O2A ) 2.7 0.0 0.7

 REMARKS hbond restraint G78 HN (slow exch) to COA O5A (phosphate O)
 assign (resid 78   and name HN    )(resid 999 and  name O5A ) 1.7 0.0 0.7
 assign (resid 78   and name N     )(resid 999 and  name O5A ) 2.7 0.0 0.7 

 REMARKS hbond restraint Q79 HN (slow exch) to COA O1A (phosphate O)
 assign (resid 79   and name HN    )(resid 999 and  name O1A ) 1.7 0.0 0.7
 assign (resid 79   and name N     )(resid 999 and  name O1A ) 2.7 0.0 0.7

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