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
621745 5ov2 34174 cing 1-original 2 AMBER distance hydrogen bond simple


#pseudohydrogen bond restraint

# 1 FA h-bond:  (1 FA5 F)-(1 FA5 H8)-(1 FA5 C8) 
 &rst     iat =    16,    25,    24,
	  r1 = 90.0, r2 = 110.0, r3 = 200.0, r4 = 201.0,
	  rk2 = 100.0, rk3 = 100.0,				&end

# 6 FA h-bond:  (6 FA F)-(6 FA H8)-(6 FA C8) 
 &rst     iat =   179,   188,   187,
	  r1 = 90.0, r2 = 110.0, r3 = 200.0, r4 = 201.0,
    	&end

# 20 FA h-bond:  (20 FA F)-(20 FA H8)-(20 FA C8) 
 &rst     iat =   628,   637,   636,
	  r1 = 90.0, r2 = 110.0, r3 = 200.0, r4 = 201.0,
    	&end

#    1  FAG F2'      1  FAG H8            2.0    3.0 
 &rst
  ixpk= 0, nxpk= 0, iat=  16,  25, r1= 1.50, r2= 2.00, r3= 3.00, r4= 3.50,  &end
#
#    6  FAG F2'      6  FAG H8            2.0    3.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 188, r1= 1.50, r2= 2.00, r3= 3.00, r4= 3.50,  &end
#
#   20  FAG F2'     20  FAG H8            2.0    3.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 628, 637, r1= 1.50, r2= 2.00, r3= 3.00, r4= 3.50,  &end
#



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