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
11117 1qxn 4776 cing 1-original 4 XPLOR/CNS distance hydrogen bond simple


! contraints defining H-bonds
assign ( segid A and residue   25 and name HN  ) ( segid A and residue  112  and name O )  1.80  0.00  0.50
assign ( segid A and residue   25 and name N  )  ( segid A and residue  112  and name O )  2.80  0.00  0.50

assign ( segid A and residue  112 and name HN  ) ( segid A and residue   23  and name O )  1.80  0.00  0.50
assign ( segid A and residue  112 and name N  )  ( segid A and residue   23  and name O )  2.80  0.00  0.50

assign ( segid A and residue   85 and name HN  ) ( segid A and residue  109  and name O )  1.80  0.00  0.50
assign ( segid A and residue   85 and name N  )  ( segid A and residue  109  and name O )  2.80  0.00  0.50

assign ( segid A and residue  111 and name HN  ) ( segid A and residue   85  and name O )  1.80  0.00  0.50
assign ( segid A and residue  111 and name N  )  ( segid A and residue   85  and name O )  2.80  0.00  0.50

assign ( segid A and residue   87 and name HN  ) ( segid A and residue  111  and name O )  1.80  0.00  0.50
assign ( segid A and residue   87 and name N  )  ( segid A and residue  111  and name O )  2.80  0.00  0.50

assign ( segid A and residue   86 and name HN  ) ( segid A and residue   41  and name O )  1.80  0.00  0.50
assign ( segid A and residue   86 and name N  )  ( segid A and residue   41  and name O )  2.80  0.00  0.50

assign ( segid A and residue   43 and name HN  ) ( segid A and residue   86  and name O )  1.80  0.00  0.50
assign ( segid A and residue   43 and name N  )  ( segid A and residue   86  and name O )  2.80  0.00  0.50

assign ( segid A and residue   88 and name HN  ) ( segid A and residue   43  and name O )  1.80  0.00  0.50
assign ( segid A and residue   88 and name N  )  ( segid A and residue   43  and name O )  2.80  0.00  0.50

assign ( segid A and residue   63 and name HN  ) ( segid A and residue   42  and name O )  1.80  0.00  0.50
assign ( segid A and residue   63 and name N  )  ( segid A and residue   42  and name O )  2.80  0.00  0.50

assign ( segid A and residue   44 and name HN  ) ( segid A and residue   63  and name O )  1.80  0.00  0.50
assign ( segid A and residue   44 and name N  )  ( segid A and residue   63  and name O )  2.80  0.00  0.50

assign ( segid A and residue   65 and name HN  ) ( segid A and residue   44  and name O )  1.80  0.00  0.50
assign ( segid A and residue   65 and name N  )  ( segid A and residue   44  and name O )  2.80  0.00  0.50

assign ( segid B and residue   25 and name HN  ) ( segid B and residue  112  and name O )  1.80  0.00  0.50
assign ( segid B and residue   25 and name N  )  ( segid B and residue  112  and name O )  2.80  0.00  0.50

assign ( segid B and residue  112 and name HN  ) ( segid B and residue   23  and name O )  1.80  0.00  0.50
assign ( segid B and residue  112 and name N  )  ( segid B and residue   23  and name O )  2.80  0.00  0.50

assign ( segid B and residue   85 and name HN  ) ( segid B and residue  109  and name O )  1.80  0.00  0.50
assign ( segid B and residue   85 and name N  )  ( segid B and residue  109  and name O )  2.80  0.00  0.50

assign ( segid B and residue  111 and name HN  ) ( segid B and residue   85  and name O )  1.80  0.00  0.50
assign ( segid B and residue  111 and name N  )  ( segid B and residue   85  and name O )  2.80  0.00  0.50

assign ( segid B and residue   87 and name HN  ) ( segid B and residue  111  and name O )  1.80  0.00  0.50
assign ( segid B and residue   87 and name N  )  ( segid B and residue  111  and name O )  2.80  0.00  0.50

assign ( segid B and residue   86 and name HN  ) ( segid B and residue   41  and name O )  1.80  0.00  0.50
assign ( segid B and residue   86 and name N  )  ( segid B and residue   41  and name O )  2.80  0.00  0.50

assign ( segid B and residue   43 and name HN  ) ( segid B and residue   86  and name O )  1.80  0.00  0.50
assign ( segid B and residue   43 and name N  )  ( segid B and residue   86  and name O )  2.80  0.00  0.50

assign ( segid B and residue   88 and name HN  ) ( segid B and residue   43  and name O )  1.80  0.00  0.50
assign ( segid B and residue   88 and name N  )  ( segid B and residue   43  and name O )  2.80  0.00  0.50

assign ( segid B and residue   63 and name HN  ) ( segid B and residue   42  and name O )  1.80  0.00  0.50
assign ( segid B and residue   63 and name N  )  ( segid B and residue   42  and name O )  2.80  0.00  0.50

assign ( segid B and residue   44 and name HN  ) ( segid B and residue   63  and name O )  1.80  0.00  0.50
assign ( segid B and residue   44 and name N  )  ( segid B and residue   63  and name O )  2.80  0.00  0.50

assign ( segid B and residue   65 and name HN  ) ( segid B and residue   44  and name O )  1.80  0.00  0.50
assign ( segid B and residue   65 and name N  )  ( segid B and residue   44  and name O )  2.80  0.00  0.50



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

Contact the webmaster for help, if required. Thursday, June 20, 2024 12:07:40 PM GMT (wattos1)