NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing in_recoord stage position program type subtype subsubtype
27889 2u1a cing recoord 1-original 2 XPLOR/CNS distance hydrogen bond simple


{H-bonds constraints}
assign (resid  16 and name HN    )
       (resid  55 and name O     )   4.90  3.10  -2.90
assign (resid  16 and name N     )
       (resid  55 and name O     )   4.90  2.20  -1.90
assign (resid  17 and name HN    )
       (resid  84 and name O     )   4.90  3.10  -2.90
assign (resid  17 and name N     )
       (resid  84 and name O     )   4.90  2.20  -1.90
assign (resid  18 and name HN    )
       (resid  53 and name O     )   4.90  3.10  -2.90
assign (resid  18 and name N     )
       (resid  53 and name O     )   4.90  2.20  -1.90
assign (resid  26 and name O     )
       (resid  30 and name HN    )   4.90  3.10  -2.90
assign (resid  26 and name O     )
       (resid  30 and name N     )   4.90  2.20  -1.90
assign (resid  26 and name OD1   )
       (resid  29 and name HN    )   4.90  3.10  -2.90
assign (resid  27 and name O     )
       (resid  31 and name HN    )   4.90  3.10  -2.90
assign (resid  27 and name O     )
       (resid  31 and name N     )   4.90  2.20  -1.90
assign (resid  28 and name O     )
       (resid  32 and name HN    )   4.90  3.10  -2.90
assign (resid  28 and name O     )
       (resid  32 and name N     )   4.90  2.20  -1.90
assign (resid  29 and name O     )
       (resid  33 and name HN    )   4.90  3.10  -2.90
assign (resid  29 and name O     )
       (resid  33 and name N     )   4.90  2.20  -1.90
assign (resid  30 and name O     )
       (resid  34 and name HN    )   4.90  3.10  -2.90
assign (resid  30 and name O     )
       (resid  34 and name N     )   4.90  2.20  -1.90
assign (resid  31 and name O     )
       (resid  35 and name HN    )   4.90  3.10  -2.90
assign (resid  31 and name O     )
       (resid  35 and name N     )   4.90  2.20  -1.90
assign (resid  32 and name O     )
       (resid  36 and name HN    )   4.90  3.10  -2.90
assign (resid  40 and name HN    )
       (resid  37 and name O     )   4.90  3.10  -2.90
assign (resid  42 and name HN    )
       (resid  56 and name O     )   4.90  3.10  -2.90
assign (resid  42 and name N     )
       (resid  56 and name O     )   4.90  2.20  -1.90
assign (resid  44 and name HN    )
       (resid  54 and name O     )   4.90  3.10  -2.90
assign (resid  44 and name N     )
       (resid  54 and name O     )   4.90  2.20  -1.90
assign (resid  53 and name HN    )
       (resid  18 and name O     )   4.90  3.10  -2.90
assign (resid  53 and name N     )
       (resid  18 and name O     )   4.90  2.20  -1.90
assign (resid  54 and name HN    )
       (resid  44 and name O     )   4.90  3.10  -2.90
assign (resid  54 and name N     )
       (resid  44 and name O     )   4.90  2.20  -1.90
assign (resid  55 and name HN    )
       (resid  16 and name O     )   4.90  3.10  -2.90
assign (resid  55 and name N     )
       (resid  16 and name O     )   4.90  2.20  -1.90
assign (resid  56 and name HN    )
       (resid  42 and name O     )   4.90  3.10  -2.90
assign (resid  56 and name N     )
       (resid  42 and name O     )   4.90  2.20  -1.90
assign (resid  57 and name HN    )
       (resid  14 and name O     )   4.90  3.10  -2.90
assign (resid  57 and name N     )
       (resid  14 and name O     )   4.90  2.20  -1.90
assign (resid  59 and name O     )
       (resid  63 and name HN    )   4.90  3.10  -2.90
assign (resid  59 and name O     )
       (resid  63 and name N     )   4.90  2.20  -1.90
assign (resid  59 and name OD1   )
       (resid  62 and name HN    )   4.90  3.10  -2.90
assign (resid  59 and name OD1   )
       (resid  62 and name N     )   4.90  2.20  -1.90
assign (resid  60 and name O     )
       (resid  64 and name HN    )   4.90  3.10  -2.90
assign (resid  60 and name O     )
       (resid  64 and name N     )   4.90  2.20  -1.90
assign (resid  61 and name O     )
       (resid  65 and name HN    )   4.90  3.10  -2.90
assign (resid  61 and name O     )
       (resid  65 and name N     )   4.90  2.20  -1.90
assign (resid  62 and name O     )
       (resid  66 and name HN    )   4.90  3.10  -2.90
assign (resid  62 and name O     )
       (resid  66 and name N     )   4.90  2.20  -1.90
assign (resid  62 and name OE1   )
       (resid  59 and name HN    )   4.90  3.10  -2.90
assign (resid  62 and name OE1   )
       (resid  59 and name N     )   4.90  2.20  -1.90
assign (resid  63 and name O     )
       (resid  67 and name HN    )   4.90  3.10  -2.90
assign (resid  63 and name O     )
       (resid  67 and name N     )   4.90  2.20  -1.90
assign (resid  64 and name O     )
       (resid  68 and name HN    )   4.90  3.10  -2.90
assign (resid  64 and name O     )
       (resid  68 and name N     )   4.90  2.20  -1.90
assign (resid  65 and name O     )
       (resid  69 and name HN    )   4.90  3.10  -2.90
assign (resid  65 and name O     )
       (resid  69 and name N     )   4.90  2.20  -1.90
assign (resid  66 and name O     )
       (resid  70 and name HN    )   4.90  3.10  -2.90
assign (resid  66 and name O     )
       (resid  70 and name N     )   4.90  2.20  -1.90
assign (resid  76 and name HN    )
       (resid  79 and name O     )   4.90  3.10  -2.90
assign (resid  81 and name HN    )
       (resid  73 and name O     )   4.90  3.10  -2.90
assign (resid  81 and name N     )
       (resid  73 and name O     )   4.90  2.20  -1.90
assign (resid  82 and name HN    )
       (resid  19 and name O     )   4.90  3.10  -2.90
assign (resid  82 and name N     )
       (resid  19 and name O     )   4.90  2.20  -1.90
assign (resid  82 and name O     )
       (resid  19 and name HN    )   4.90  3.10  -2.90
assign (resid  82 and name O     )
       (resid  19 and name N     )   4.90  2.20  -1.90
assign (resid  84 and name HN    )
       (resid  17 and name O     )   4.90  3.10  -2.90
assign (resid  84 and name N     )
       (resid  17 and name O     )   4.90  2.20  -1.90


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

Contact the webmaster for help, if required. Friday, May 17, 2024 2:49:51 PM GMT (wattos1)