NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing in_recoord stage position program type subtype subsubtype

6768 1ji8 5115 cing recoord 1-original 2 XPLOR/CNS distance hydrogen bond simple

remarks  a-helix H-bond constraints (slow exchangers only)
assign (resid   31 and  name O    )(resid   35 and  name HN   ) 1.8 0.0 0.4
assign (resid   31 and  name O    )(resid   35 and  name N    ) 2.8 0.0 0.5
assign (resid   32 and  name O    )(resid   36 and  name HN   ) 1.8 0.0 0.4
assign (resid   32 and  name O    )(resid   36 and  name N    ) 2.8 0.0 0.5
assign (resid   33 and  name O    )(resid   37 and  name HN   ) 1.8 0.0 0.4
assign (resid   33 and  name O    )(resid   37 and  name N    ) 2.8 0.0 0.5
assign (resid   34 and  name O    )(resid   38 and  name HN   ) 1.8 0.0 0.4
assign (resid   34 and  name O    )(resid   38 and  name N    ) 2.8 0.0 0.5
assign (resid   35 and  name O    )(resid   39 and  name HN   ) 1.8 0.0 0.4
assign (resid   35 and  name O    )(resid   39 and  name N    ) 2.8 0.0 0.5
assign (resid   36 and  name O    )(resid   40 and  name HN   ) 1.8 0.0 0.4
assign (resid   36 and  name O    )(resid   40 and  name N    ) 2.8 0.0 0.5
assign (resid   37 and  name O    )(resid   41 and  name HN   ) 1.8 0.0 0.4
assign (resid   37 and  name O    )(resid   41 and  name N    ) 2.8 0.0 0.5
assign (resid   38 and  name O    )(resid   42 and  name HN   ) 1.8 0.0 0.4
assign (resid   38 and  name O    )(resid   42 and  name N    ) 2.8 0.0 0.5
assign (resid   51 and  name O    )(resid   55 and  name HN   ) 1.8 0.0 0.4
assign (resid   51 and  name O    )(resid   55 and  name N    ) 2.8 0.0 0.5
assign (resid   52 and  name O    )(resid   56 and  name HN   ) 1.8 0.0 0.4
assign (resid   52 and  name O    )(resid   56 and  name N    ) 2.8 0.0 0.5
assign (resid   53 and  name O    )(resid   57 and  name HN   ) 1.8 0.0 0.4
assign (resid   53 and  name O    )(resid   57 and  name N    ) 2.8 0.0 0.5
assign (resid   54 and  name O    )(resid   58 and  name HN   ) 1.8 0.0 0.4
assign (resid   54 and  name O    )(resid   58 and  name N    ) 2.8 0.0 0.5
assign (resid   55 and  name O    )(resid   59 and  name HN   ) 1.8 0.0 0.4
assign (resid   55 and  name O    )(resid   59 and  name N    ) 2.8 0.0 0.5
assign (resid   59 and  name O    )(resid   63 and  name HN   ) 1.8 0.0 0.4
assign (resid   59 and  name O    )(resid   63 and  name N    ) 2.8 0.0 0.5
assign (resid   83 and  name O    )(resid   87 and  name HN   ) 1.8 0.0 0.4
assign (resid   83 and  name O    )(resid   87 and  name N    ) 2.8 0.0 0.5
assign (resid   84 and  name O    )(resid   88 and  name HN   ) 1.8 0.0 0.4
assign (resid   84 and  name O    )(resid   88 and  name N    ) 2.8 0.0 0.5
assign (resid   85 and  name O    )(resid   89 and  name HN   ) 1.8 0.0 0.4
assign (resid   85 and  name O    )(resid   89 and  name N    ) 2.8 0.0 0.5
assign (resid   86 and  name O    )(resid   90 and  name HN   ) 1.8 0.0 0.4
assign (resid   86 and  name O    )(resid   90 and  name N    ) 2.8 0.0 0.5
assign (resid   96 and  name O    )(resid  100 and  name HN   ) 1.8 0.0 0.4
assign (resid   96 and  name O    )(resid  100 and  name N    ) 2.8 0.0 0.5
assign (resid   97 and  name O    )(resid  101 and  name HN   ) 1.8 0.0 0.4
assign (resid   97 and  name O    )(resid  101 and  name N    ) 2.8 0.0 0.5
assign (resid   98 and  name O    )(resid  102 and  name HN   ) 1.8 0.0 0.4
assign (resid   98 and  name O    )(resid  102 and  name N    ) 2.8 0.0 0.5
assign (resid   99 and  name O    )(resid  103 and  name HN   ) 1.8 0.0 0.4
assign (resid   99 and  name O    )(resid  103 and  name N    ) 2.8 0.0 0.5

remarks  B-sheet H-bond constraints (slow exchangers only)
assign (resid   18 and  name O    )(resid    7 and  name HN   ) 1.8 0.0 0.4
assign (resid   18 and  name O    )(resid    7 and  name N    ) 2.8 0.0 0.5
assign (resid    7 and  name O    )(resid   18 and  name HN   ) 1.8 0.0 0.4
assign (resid    7 and  name O    )(resid   18 and  name N    ) 2.8 0.0 0.5
assign (resid   16 and  name O    )(resid    9 and  name HN   ) 1.8 0.0 0.4
assign (resid   16 and  name O    )(resid    9 and  name N    ) 2.8 0.0 0.5
assign (resid    9 and  name O    )(resid   16 and  name HN   ) 1.8 0.0 0.4
assign (resid    9 and  name O    )(resid   16 and  name N    ) 2.8 0.0 0.5
assign (resid   23 and  name O    )(resid   19 and  name HN   ) 1.8 0.0 0.4
assign (resid   23 and  name O    )(resid   19 and  name N    ) 2.8 0.0 0.5

remarks other H-bonds
assign (resid  101 and  name O    )(resid   30 and  name HE1  ) 1.8 0.0 0.4
assign (resid  101 and  name O    )(resid   30 and  name NE1  ) 2.8 0.0 0.5

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Contact the webmaster for help, if required. Friday, May 10, 2024 2:51:40 PM GMT (wattos1)

image	mrblock_id	pdb_id	bmrb_id	cing	in_recoord	stage	position	program	type	subtype	subsubtype
	6768	1ji8	5115	cing	recoord	1-original	2	XPLOR/CNS	distance	hydrogen bond	simple