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

583501 2mko cing 1-original 4 AMBER distance hydrogen bond simple

#HBOND
#   1 DG5  H1      6 DG   O6      1.70 1.90
 &rst
  ixpk= 0, nxpk= 0, iat=  19, 180, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#   1 DG5  H21     6 DG   N7      1.90 2.10
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 177, r1= 1.40, r2= 1.90, r3= 2.10, r4= 2.60,  &end
#
#   5 DG   H1      2 DG   O6      1.70 1.90
 &rst
  ixpk= 0, nxpk= 0, iat= 149,  50, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40,  &end
#
#   5 DG   H21     2 DG   N7      1.90 2.10
 &rst
  ixpk= 0, nxpk= 0, iat= 152,  47, r1= 1.40, r2= 1.90, r3= 2.10, r4= 2.60,  &end
#
#   6 DG   H1     10 DG   O6      1.70 1.90
 &rst
  ixpk= 0, nxpk= 0, iat= 182, 310, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40,  &end
#
#   6 DG   H21    10 DG   N7      1.90 2.10
#&rst
# ixpk= 0, nxpk= 0, iat= 185, 307, r1= 1.40, r2= 1.90, r3= 2.10, r4= 2.60,  &end
#
#  11 DG3  H1      5 DG   O6      1.70 1.90
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 147, r1= 1.20, r2= 1.70, r3= 1.90, r4= 2.40,  &end
#
#  11 DG3  H21     5 DG   N7      1.90 2.10
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 144, r1= 1.40, r2= 1.90, r3= 2.10, r4= 2.60,  &end
#
#   1 DG5  H1      6 DG   C6      2.50 3.20
 &rst
  ixpk= 0, nxpk= 0, iat=  19, 179, r1= 2.00, r2= 2.50, r3= 3.20, r4= 3.70,  &end
#
#   6 DG   O6      1 DG5  N1      2.50 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 180,  18, r1= 2.00, r2= 2.50, r3= 3.20, r4= 3.70,  &end
#
#   5 DG   H1      2 DG   C6      2.50 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 149,  49, r1= 2.00, r2= 2.50, r3= 3.20, r4= 3.70,  &end
#
#   2 DG   O6      5 DG   N1      2.50 3.20
 &rst
  ixpk= 0, nxpk= 0, iat=  50, 148, r1= 2.00, r2= 2.50, r3= 3.20, r4= 3.70,  &end
#
#   6 DG   H1     10 DG   C6      2.50 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 182, 309, r1= 2.00, r2= 2.50, r3= 3.20, r4= 3.70,  &end
#
#  10 DG   O6      6 DG   N1      2.50 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 181, r1= 2.00, r2= 2.50, r3= 3.20, r4= 3.70,  &end
#
#  11 DG3  H1      5 DG   C6      2.50 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 146, r1= 2.00, r2= 2.50, r3= 3.20, r4= 3.70,  &end
#
#   5 DG   O6     11 DG3  N1      2.50 3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 147, 344, r1= 2.00, r2= 2.50, r3= 3.20, r4= 3.70,  &end
#
#   1 DG5  N1      6 DG   C6      3.40 4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  18, 179, r1= 2.90, r2= 3.40, r3= 4.10, r4= 4.60,  &end
#
#   5 DG   N1      2 DG   C6      3.40 4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 148,  49, r1= 2.90, r2= 3.40, r3= 4.10, r4= 4.60,  &end
#
#   6 DG   N1     10 DG   C6      3.40 4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 181, 309, r1= 2.90, r2= 3.40, r3= 4.10, r4= 4.60,  &end
#
#  11 DG3  N1      5 DG   C6      3.40 4.10
 &rst
  ixpk= 0, nxpk= 0, iat= 344, 146, r1= 2.90, r2= 3.40, r3= 4.10, r4= 4.60,  &end
#
#   1 DG5  N2      6 DG   N7      2.60 3.00
 &rst
  ixpk= 0, nxpk= 0, iat=  21, 177, r1= 2.10, r2= 2.60, r3= 3.00, r4= 3.50,  &end
#
#   5 DG   N2      2 DG   N7      2.60 3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 151,  47, r1= 2.10, r2= 2.60, r3= 3.00, r4= 3.50,  &end
#
#   6 DG   N2     10 DG   N7      2.60 3.00
#&rst
# ixpk= 0, nxpk= 0, iat= 184, 307, r1= 2.10, r2= 2.60, r3= 3.00, r4= 3.50,  &end
#
#  11 DG3  N2      5 DG   N7      2.60 3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 144, r1= 2.10, r2= 2.60, r3= 3.00, r4= 3.50,  &end

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image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype	subsubtype
	583501	2mko	cing	1-original	4	AMBER	distance	hydrogen bond	simple