NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
578603 2m5e 19050 cing 1-original 5 XPLOR/CNS distance general distance simple 

! "H-bond" restraints for positioning Ca++ based on 1EXR crystal structure
! only keep restraints <= 3.5 A, add wildcards for possible name clashes
! OE1 and OE2 both kept but set to slightly longer of 2 distances
assign ( resid 2001 and name "CA+2" ) ( resid   93 and name OD# ) 2.300  0.500  0.500
assign ( resid 2001 and name "CA+2" ) ( resid   95 and name OD# ) 2.330  0.500  0.500 
assign ( resid 2001 and name "CA+2" ) ( resid   97 and name OD1 ) 2.420  0.500  0.500
assign ( resid 2001 and name "CA+2" ) ( resid  104 and name OE1 ) 2.540  0.500  0.500
assign ( resid 2001 and name "CA+2" ) ( resid  104 and name OE2 ) 2.540  0.500  0.500
assign ( resid 2001 and name "CA+2" ) ( resid   99 and name   O ) 2.280  0.500  0.500
assign ( resid 2002 and name "CA+2" ) ( resid  129 and name OD# ) 2.300  0.500  0.500
assign ( resid 2002 and name "CA+2" ) ( resid  131 and name OD# ) 2.340  0.500  0.500
assign ( resid 2002 and name "CA+2" ) ( resid  133 and name OD# ) 2.380  0.500  0.500
assign ( resid 2002 and name "CA+2" ) ( resid  140 and name OE1 ) 2.550  0.500  0.500
assign ( resid 2002 and name "CA+2" ) ( resid  140 and name OE2 ) 2.550  0.500  0.500
assign ( resid 2002 and name "CA+2" ) ( resid  135 and name   O ) 2.350  0.500  0.500

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