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
7061 1jy6 cing 1-original 1 DYANA/DIANA distance NOE simple


# Sequential NOEs
# for one protomer (1-35)
  12 THR  HA      12 THR  HN      3.0    # weak
  12 THR  HA      13 ALA  HN      2.0    # strong
  13 ALA  HA      13 ALA  HN      3.0    # weak
  13 ALA  HA      14 LEU  HN      2.0    # strong
  14 LEU  HA      14 LEU  HN      3.0    # weak
  14 LEU  HA      15 ASN  HN      2.0    # strong
  15 ASN  HA      15 ASN  HN      3.0    # weak
  15 ASN  HA      16 THR  HN      2.0    # strong
  16 THR  HA      16 THR  HN      3.0    # weak
  17 DPRO HA      18 ALA  HN      2.0    # strong
  18 ALA  HA      18 ALA  HN      2.5    # medium
  18 ALA  HA      19 VAL  HN      3.0    # weak
  19 VAL  HA      19 VAL  HN      3.0    # weak
  19 VAL  HA      20 GLN  HN      2.0    # strong
  20 GLN  HA      20 GLN  HN      3.0    # weak
  20 GLN  HA      21 LYS  HN      2.0    # strong
  21 LYS  HA      21 LYS  HN      3.0    # weak
  21 LYS  HA      22 TRP  HN      2.0    # strong
  22 TRP  HA      22 TRP  HN      3.0    # weak
  22 TRP  HA      23 HIS  HN      2.0    # strong
  23 HIS  HA      23 HIS  HN      3.0    # weak
  23 HIS  HA      24 PHE  HN      2.0    # strong
  24 PHE  HA      24 PHE  HN      3.0    # weak
  24 PHE  HA      25 VAL  HN      2.0    # strong
  25 VAL  HA      25 VAL  HN      3.0    # weak
  25 VAL  HA      26 LEU  HN      2.0    # strong
  26 LEU  HA      26 LEU  HN      3.0    # weak
  27 DPRO HA      28 GLY  HN      2.0    # strong
  28 GLY  HA1     28 GLY  HN      2.5    # medium
  28 GLY  HA1     29 TYR  HN      3.0    # weak
  29 TYR  HA      29 TYR  HN      3.0    # weak
  29 TYR  HA      30 LYS  HN      2.0    # strong
  30 LYS  HA      30 LYS  HN      3.0    # weak
  30 LYS  HA      31 CYSS HN      2.0    # strong
  31 CYSS HA      31 CYSS HN      3.0    # weak
  31 CYSS HA      32 GLU  HN      2.0    # strong
  32 GLU  HA      32 GLU  HN      3.0    # weak
  32 GLU  HA      33 ILE  HN      2.0    # strong
  33 ILE  HA      33 ILE  HN      3.0    # weak
  33 ILE  HA      34 LEU  HN      2.0    # strong
  34 LEU  HA      34 LEU  HN      3.0    # weak
  34 LEU  HA      35 ALA  HN      2.0    # strong
  35 ALA  HA      35 ALA  HN      3.0    # weak

# for second protomer (201-235)
   212 THR  HA       212 THR  HN      3.0    # weak
   212 THR  HA       213 ALA  HN      2.0    # strong
   213 ALA  HA       213 ALA  HN      3.0    # weak
   213 ALA  HA       214 LEU  HN      2.0    # strong
   214 LEU  HA       214 LEU  HN      3.0    # weak
   214 LEU  HA       215 ASN  HN      2.0    # strong
   215 ASN  HA       215 ASN  HN      3.0    # weak
   215 ASN  HA       216 THR  HN      2.0    # strong
   216 THR  HA       216 THR  HN      3.0    # weak
   217 DPRO HA       218 ALA  HN      2.0    # strong
   218 ALA  HA       218 ALA  HN      2.5    # medium
   218 ALA  HA       219 VAL  HN      3.0    # weak
   219 VAL  HA       219 VAL  HN      3.0    # weak
   219 VAL  HA       220 GLN  HN      2.0    # strong
   220 GLN  HA       220 GLN  HN      3.0    # weak
   220 GLN  HA       221 LYS  HN      2.0    # strong
   221 LYS  HA       221 LYS  HN      3.0    # weak
   221 LYS  HA       222 TRP  HN      2.0    # strong
   222 TRP  HA       222 TRP  HN      3.0    # weak
   222 TRP  HA       223 HIS  HN      2.0    # strong
   223 HIS  HA       223 HIS  HN      3.0    # weak
   223 HIS  HA       224 PHE  HN      2.0    # strong
   224 PHE  HA       224 PHE  HN      3.0    # weak
   224 PHE  HA       225 VAL  HN      2.0    # strong
   225 VAL  HA       225 VAL  HN      3.0    # weak
   225 VAL  HA       226 LEU  HN      2.0    # strong
   226 LEU  HA       226 LEU  HN      3.0    # weak
   227 DPRO HA       228 GLY  HN      2.0    # strong
   228 GLY  HA1      228 GLY  HN      2.5    # medium
   228 GLY  HA1      229 TYR  HN      3.0    # weak
   229 TYR  HA       229 TYR  HN      3.0    # weak
   229 TYR  HA       230 LYS  HN      2.0    # strong
   230 LYS  HA       230 LYS  HN      3.0    # weak
   230 LYS  HA       231 CYSS HN      2.0    # strong
   231 CYSS HA       231 CYSS HN      3.0    # weak
   231 CYSS HA       232 GLU  HN      2.0    # strong
   232 GLU  HA       232 GLU  HN      3.0    # weak
   232 GLU  HA       233 ILE  HN      2.0    # strong
   233 ILE  HA       233 ILE  HN      3.0    # weak
   233 ILE  HA       234 LEU  HN      2.0    # strong
   234 LEU  HA       234 LEU  HN      3.0    # weak
   234 LEU  HA       235 ALA  HN      2.0    # strong
   235 ALA  HA       235 ALA  HN      3.0    # weak
 
   #Across strand NOEs

#for one protomer
  14 LEU  HN     21 LYS  HN      3.5    # weak
  20 GLN  HN     35 ALA  HN      3.5    # weak
  22 TRP  HN     33 ILE  HN      3.5    # weak
  24 PHE  HN     31 CYSS HN      3.5    # weak
  26 LEU  HN     29 TYR  HN      3.5    # weak
  15 ASN  HA     20 GLN  HA      2.5    # medium
  13 ALA  HA     22 TRP  HA      2.5    # medium
  25 VAL  HA     30 LYS  HA      2.5    # medium
  23 HIS  HA     32 GLU  HA      2.5    # medium
  21 LYS  HA     34 LEU  HA      2.5    # medium

  25 VAL  HA     31 CYSS HN      2.5    # medium

#for second protomer
  214 LEU  HN     221 LYS  HN      3.5    # weak
  220 GLN  HN     235 ALA  HN      3.5    # weak
  222 TRP  HN     233 ILE  HN      3.5    # weak
  224 PHE  HN     231 CYSS HN      3.5    # weak
  226 LEU  HN     229 TYR  HN      3.5    # weak
  215 ASN  HA     220 GLN  HA      2.5    # medium
  213 ALA  HA     222 TRP  HA      2.5    # medium
  225 VAL  HA     230 LYS  HA      2.5    # medium
  223 HIS  HA     232 GLU  HA      2.5    # medium
  221 LYS  HA     234 LEU  HA      2.5    # medium

  225 VAL  HA     231 CYSS HN      2.5    # medium

# across interface

  30 LYS  HN     232 GLU  HN      3.5    # weak
  32 GLU  HN     230 LYS  HN      3.5    # weak
  29 TYR  HA     233 ILE  HA      2.5    # medium
  33 ILE  HA     229 TYR  HA      2.5    # medium

  30 LYS  HN     233 ILE  HA      2.5    # medium
  230 LYS  HN     33 ILE  HA      2.5    # medium

  31 CYSS 
         CB     231 CYSS SG      3.00  5.00E+00              
         SG     231 CYSS CB      3.00  5.00E+00              
         SG     231 CYSS SG      2.00  5.00E+00              

  # Sequential (turn) NOEs

   28 GLY  HN     29 TYR  HN      2.0    # strong

   228 GLY  HN     229 TYR  HN      2.0    # strong

 # alpha-delta NOEs

  16 THR  HA     17 DPRO QD     2.0    # strong
  26 LEU  HA     27 DPRO QD     2.0    # strong
  216 THR  HA     217 DPRO QD     2.0    # strong
  226 LEU  HA     227 DPRO QD     2.0    # strong


# sc/ar NOEs

    22 TRP  HD1     33 ILE HB      3.5    # weak
   222 TRP  HD1    233 ILE HB      3.5    # weak

    23 HIS  HD2     25 VAL QG2     3.5    # weak
   223 HIS  HD2    225 VAL QG2     3.5    # weak
    24 PHE  QE      26 LEU HG      2.5    # medium
   224 PHE  QE     226 LEU HG      2.5    # medium

    29 TYR  QE     233 ILE QD1     3.5    # weak
    29 TYR  QD     233 ILE QD1     3.5    # weak
   229 TYR  QE      33 ILE QD1     3.5    # weak
   229 TYR  QD      33 ILE QD1     3.5    # weak
    29 TYR  QE     233 ILE QG2     3.5    # weak
    29 TYR  QD     233 ILE QG2     3.5    # weak
   229 TYR  QE      33 ILE QG2     3.5    # weak
   229 TYR  QD      33 ILE QG2     3.5    # weak



Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Sunday, April 28, 2024 10:33:26 AM GMT (wattos1)