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
7053 1jxc 5056 cing 1-original 4 DYANA/DIANA distance NOE simple


#  3 GLU  HB3    13 LYS  HA      5.50   # peak     25
  4 ILE  HB     13 LYS  HB3     5.50   # peak   1815
  4 ILE  HB     17 GLY  HA1     5.50   # peak    107
 # 4 ILE  QG2     7 GLN  HB2     6.53   # peak   2134
  4 ILE  QG2    15 TYR  HB3     6.53   # peak   2123
#  4 ILE  HG12   15 TYR  HB2     5.50   # peak    393
  4 ILE  QD1    57 LYS  HB2     6.53   # peak   1929
#  4 ILE  QD1    63 CYSS HB2     6.53   # peak    234
#  5 GLU  HB3    13 LYS  HA      5.50   # peak     26
#  6 ALA  QB     10 GLU  HB2     6.53   # peak    791
  6 ALA  QB     57 LYS  HE2     6.53   # peak   1558
#  9 ASN  HA     57 LYS  HE2     5.50   # peak   1133
#  9 ASN  QB     11 CYSS HA      6.38   # peak     47
# 10 GLU  HB2    59 LEU  HB2     5.50   # peak    546
 10 GLU  HB3    12 LEU  QD1     6.53   # peak    592
 10 GLU  HB3    47 ARG  HG3     5.50   # peak    586
# 10 GLU  QG     48 CYSS HB2     6.38   # peak   1462
 11 CYSS HB3    63 CYSS HA      5.50   # peak     57
 12 LEU  HG     47 ARG  HB3     5.50   # peak   1847
 12 LEU  QD1    59 LEU  HB3     6.53   # peak    868
# 14 GLU  QB     63 CYSS HB2     6.38   # peak    226
# 15 TYR  HB2    59 LEU  HA      5.50   # peak     43
 15 TYR  HB2    61 ASP  HB2     5.50   # peak    380
 15 TYR  HB2    62 PHE  QD      7.62   # peak    973
# 15 TYR  HB2    63 CYSS HB3     5.50   # peak    337
 15 TYR  HB3    36 ARG  HD3     5.50   # peak   1645
# 15 TYR  HB3    58 CYSS HB3     5.50   # peak   1629
# 15 TYR  HB3    59 LEU  HA      5.50   # peak   1138
 15 TYR  QE     43 ALA  QB      8.66   # peak   1055
# 16 GLY  HA2    59 LEU  HB3     5.50   # peak    277
 18 ASP  HB2    23 PHE  HB2     5.50   # peak   1602
 18 ASP  HB2    58 CYSS HB3     5.50   # peak   1600
 18 ASP  HB3    23 PHE  HB3     5.50   # peak    442
 18 ASP  HB3    36 ARG  HD2     5.50   # peak    379
# 19 VAL  QG2    56 VAL  QG1     7.56   # peak   2285
 19 VAL  QG2    58 CYSS HB3     6.53   # peak   2281
# 20 GLY  HA1    47 ARG  HA      5.50   # peak   1371
# 20 GLY  HA1    49 ARG  HA      5.50   # peak   1370
# 20 GLY  HA1    56 VAL  HA      5.50   # peak   1176
# 20 GLY  HA1    59 LEU  HA      5.50   # peak   1141
# 20 GLY  HA1    60 CYSS HB2     5.50   # peak    358
  21 PHE  HA     52 GLN  HB2     5.50   # peak   1382
# 21 PHE  HA     56 VAL  HA      5.50   # peak   1179
# 21 PHE  HA     57 LYS  HA      5.50   # peak   1162
 21 PHE  HB2    51 GLY  HA2     5.50   # peak   1398
 21 PHE  HB3    50 TRP  HB3     5.50   # peak    327
 21 PHE  HB3    51 GLY  HA2     5.50   # peak   1407
# 22 GLY  QA     33 CYSS HB2     6.38   # peak    385
 23 PHE  HB2    33 CYSS HB3     5.50   # peak   1622
 23 PHE  HB2    58 CYSS HB2     5.50   # peak    422
 23 PHE  HB3    36 ARG  HD3     5.50   # peak    460
 23 PHE  HB3    60 CYSS HB3     5.50   # peak   1616
 24 CYSS HB2    58 CYSS HB3     5.50   # peak    405
# 31 THR  HA     53 GLY  HA2     5.50   # peak    113

 40 ASN  HB3    60 CYSS HB3     5.50   # peak   1536
 40 ASN  HD22   60 CYSS HB2     5.50   # peak    982
 41 LYS  HB2    62 PHE  QE      7.62   # peak   1019
# 44 LYS  HA     59 LEU  HG      5.50   # peak   1271
 44 LYS  HB3    62 PHE  HB3     5.50   # peak    395
 44 LYS  HD2    63 CYSS HB3     5.50   # peak   1972
 44 LYS  HD2    68 GLN  HB2     5.50   # peak    531
# 45 GLY  HA2    63 CYSS HB2     5.50   # peak   1378
 45 GLY  HA2    65 ASP  HB2     5.50   # peak    424

#h2o14

#d2o20
 21 PHE  HN     51 GLY  HA1     5.50   # peak     10
# 21 PHE  HN     56 VAL  HA      5.50   # peak      9
 #21 PHE  HN     57 LYS  HA      5.50   # peak      6


#d2o21

  3 GLU  HB2    14 GLU  QG      6.38   # peak   1703
  3 GLU  HB2    15 TYR  HA      5.50   # peak   1319
  3 GLU  HB3    14 GLU  QG      6.38   # peak    511
  4 ILE  HB     13 LYS  HB3     5.50   # peak   1815
  4 ILE  HB     14 GLU  QG      6.38   # peak    519
  4 ILE  QD1    12 LEU  QD1     7.56   # peak    723
  4 ILE  QD1    57 LYS  HG2     6.53   # peak    767
#  6 ALA  QB     13 LYS  QE      7.40   # peak   1614
  6 ALA  QB     57 LYS  HE2     6.53   # peak   1558
  7 GLN  HB3    10 GLU  HB2     5.50   # peak   1770
  7 GLN  HB3    10 GLU  HB3     5.50   # peak   1782
  7 GLN  HB3    10 GLU  QG      6.38   # peak    502
# 13 LYS  QE     62 PHE  HB3     6.38   # peak    378
# 14 GLU  QG     57 LYS  HB2     6.38   # peak   1705
 14 GLU  QG     61 ASP  HB3     6.38   # peak    514
 15 TYR  HA     61 ASP  HB3     5.50   # peak   1320
 15 TYR  QD     62 PHE  HZ      7.64   # peak    955
 23 PHE  HZ     52 GLN  QG      6.38   # peak   1663
# 33 CYSS HB2    36 ARG  HA      5.50   # peak    158
 33 CYSS HB2    36 ARG  HB3     5.50   # peak   1571
 33 CYSS HB2    37 CYSS HB2     5.50   # peak   1552
 33 CYSS HB3    37 CYSS HB3     5.50   # peak   1675


#h2o15
 13 LYS  HN     64 GLY  HA2     5.50   # peak    150
# 18 ASP  HN     59 LEU  HA      5.50   # peak      3
# 20 GLY  HN     57 LYS  HG2     5.50   # peak     93
 24 CYSS HN     33 CYSS HN      5.50   # peak    311
# 35 THR  HN     54 SER  QB      6.38   # peak     43
# 49 ARG  HN     56 VAL  HA      5.50   # peak      8
 47 ARG  HE     64 GLY  HA1     5.50   # peak     44



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