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

608155 5hqq 30016 cing 1-original 2 AMBER distance hydrogen bond simple

# WC - distances
#
#
#
# Watson-Creek - distances
#
#   7  CYT  H42    16  GUA  O6      1.80   2.00
# &rst
#  ixpk= 0, nxpk= 0, iat=  192, 473, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, 
#      rk2=50.0, rk3=50.0, ir6=1, ialtd=0,
# &end
#
#   7  CYT  N3     16  GUA  H1      1.84   2.04
# &rst
#  ixpk= 0, nxpk= 0, iat= 193, 475, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#   7  CYT  N3     16  GUA  N1      2.85   3.05
# &rst
#  ixpk= 0, nxpk= 0, iat= 193, 474, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#   7  CYT  N4     16  GUA  O6      2.81   3.01
# &rst
#  ixpk= 0, nxpk= 0, iat= 190, 473, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#   7  CYT  O2     16  GUA  H22     1.75   1.95
# &rst
#  ixpk= 0, nxpk= 0, iat= 195, 479, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#
#   1  CYT  H42    22  GUA  O6      1.80   2.00
 &rst
  ixpk= 0, nxpk= 0, iat=  19, 667, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, 
      rk2=32.0, rk3=32.0, ir6=1, ialtd=0,
 &end
#
#   1  CYT  N3     22  GUA  H1      1.84   2.04
 &rst
  ixpk= 0, nxpk= 0, iat=  20, 669, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#   1  CYT  N3     22  GUA  N1      2.85   3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  20, 668, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#   1  CYT  N4     22  GUA  O6      2.81   3.01
 &rst
  ixpk= 0, nxpk= 0, iat=  17, 667, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#   1  CYT  O2     22  GUA  H22     1.75   1.95
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 673, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#
#   2  GUA  H1     21  CYT  N3      1.84   2.04
 &rst
  ixpk= 0, nxpk= 0, iat=  49, 640, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#   2  GUA  H22    21  CYT  O2      1.75   1.95
 &rst
  ixpk= 0, nxpk= 0, iat=  53, 642, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#
#   2  GUA  N1     21  CYT  N3      2.85   3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  48, 640, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#   2  GUA  O6     21  CYT  H42     1.80   2.00
 &rst
  ixpk= 0, nxpk= 0, iat=  47, 639, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#   2  GUA  O6     21  CYT  N4      2.81   3.01
 &rst
  ixpk= 0, nxpk= 0, iat=  47, 637, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#   4  THY  H3     19  ADE  N1      1.71   1.91
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 575, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#   4  THY  N3     19  ADE  N1      2.72   2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 575, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
#
#   4  THY  O4     19  ADE  H61     1.84   2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 573, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#   8  ADE  H61    15  THY  O4      1.84   2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 221, 444, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#   8  ADE  N1     15  THY  H3      1.71   1.91
 &rst
  ixpk= 0, nxpk= 0, iat= 223, 446, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41,  &end
#
#   8  ADE  N1     15  THY  N3      2.72   2.92
 &rst
  ixpk= 0, nxpk= 0, iat= 223, 445, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42,  &end
#
#   3  CYT  H42    20  GUA  O6      1.80   2.00
 &rst
  ixpk= 0, nxpk= 0, iat=  82, 604, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#   3  CYT  N3     20  GUA  H1      1.84   2.04
 &rst
  ixpk= 0, nxpk= 0, iat=  83, 606, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#   3  CYT  N3     20  GUA  N1      2.85   3.05
 &rst
  ixpk= 0, nxpk= 0, iat=  83, 605, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#   3  CYT  N4     20  GUA  O6      2.81   3.01
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 604, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#   3  CYT  O2     20  GUA  H22     1.75   1.95
 &rst
  ixpk= 0, nxpk= 0, iat=  85, 610, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#
#  10  GUA  H1     13  CYT  N3      1.84   2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 284, 380, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  10  GUA  H22    13  CYT  O2      1.75   1.95
 &rst
  ixpk= 0, nxpk= 0, iat= 288, 382, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#
#  10  GUA  N1     13  CYT  N3      2.85   3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 283, 380, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#  10  GUA  O6     13  CYT  H42     1.80   2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 379, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  10  GUA  O6     13  CYT  N4      2.81   3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 282, 377, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#  11  CYT  H42    12  GUA  O6      1.80   2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 344, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  11  CYT  N3     12  GUA  H1      1.84   2.04
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 346, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,  &end
#
#  11  CYT  N3     12  GUA  N1      2.85   3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 345, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55,  &end
#
#  11  CYT  N4     12  GUA  O6      2.81   3.01
 &rst
  ixpk= 0, nxpk= 0, iat= 315, 344, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51,  &end
#
#  11  CYT  O2     12  GUA  H22     1.75   1.95
 &rst
  ixpk= 0, nxpk= 0, iat= 320, 350, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45,  &end
#

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image	mrblock_id	pdb_id	bmrb_id	cing	stage	position	program	type	subtype	subsubtype
	608155	5hqq	30016	cing	1-original	2	AMBER	distance	hydrogen bond	simple