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

23783 2jyb cing 1-original 3 XPLOR/CNS distance hydrogen bond simple


!class hbonds
!
!H-Bonds (29)
assign (resid 4 and name HN)(resid 97 and name O       ) 2.1  0.6  1.0
assign (resid 4 and name  N)(resid 97 and name O       ) 3.0  0.5  1.0
!
assign (resid 5 and name HN)(resid 115 and name O      ) 2.1  0.6  1.0
assign (resid 5 and name  N)(resid 115 and name O      ) 3.0  0.5  1.0
!
assign (resid 31 and name HN)(resid 27 and name O      ) 2.1  0.6  0.5
assign (resid 31 and name  N)(resid 27 and name O      ) 3.0  0.5  0.5
!
assign (resid 33 and name HN)(resid 29 and name O      ) 2.1  0.6  1.0
assign (resid 33 and name  N)(resid 29 and name O      ) 3.0  0.5  1.0
!
assign (resid 35 and name HN)(resid 31 and name O      ) 2.1  0.6  1.0
assign (resid 35 and name  N)(resid 31 and name O      ) 3.0  0.5  1.0
!
assign (resid 44 and name HN)(resid 62 and name O      ) 2.1  0.6  0.5
assign (resid 44 and name  N)(resid 62 and name O      ) 3.0  0.5  0.5
!
assign (resid 45 and name HN)(resid 101 and name O     ) 2.1  0.6  0.5
assign (resid 45 and name  N)(resid 101 and name O     ) 3.0  0.5  0.5
!
assign (resid 52 and name HN)(resid 48 and name O      ) 2.1  0.6  1.0
assign (resid 52 and name  N)(resid 48 and name O      ) 3.0  0.5  1.0
!
assign (resid 61 and name HN)(resid 75 and name O      ) 2.1  0.6  0.5
assign (resid 61 and name  N)(resid 75 and name O      ) 3.0  0.5  0.5
!
assign (resid 62 and name HN)(resid 42 and name O      ) 2.1  0.6  0.5
assign (resid 62 and name  N)(resid 42 and name O      ) 3.0  0.5  0.5
!
assign (resid 64 and name HN)(resid 44 and name O      ) 2.1  0.6  0.5
assign (resid 64 and name  N)(resid 44 and name O      ) 3.0  0.5  0.5
!
assign (resid 65 and name HN)(resid 79 and name O      ) 2.1  0.6  0.5
assign (resid 65 and name  N)(resid 79 and name O      ) 3.0  0.5  0.5
!
assign (resid 79 and name HN)(resid 63 and name O      ) 2.1  0.6  0.5
assign (resid 79 and name  N)(resid 63 and name O      ) 3.0  0.5  0.5
!
assign (resid 85 and name HN)(resid 81 and name O      ) 2.1  0.6  1.0
assign (resid 85 and name  N)(resid 81 and name O      ) 3.0  0.5  1.0
!
assign (resid 87 and name HN)(resid 83 and name O      ) 2.1  0.6  1.0
assign (resid 87 and name  N)(resid 83 and name O      ) 3.0  0.5  1.0
!
assign (resid 89 and name HN)(resid 85 and name O      ) 2.1  0.6  1.0
assign (resid 89 and name  N)(resid 85 and name O      ) 3.0  0.5  1.0
!
assign (resid 91 and name HN)(resid 87 and name O      ) 2.1  0.6  1.0
assign (resid 91 and name  N)(resid 87 and name O      ) 3.0  0.5  1.0
!
assign (resid 97 and name HN)(resid 2 and name O       ) 2.1  0.6  0.5
assign (resid 97 and name  N)(resid 2 and name O       ) 3.0  0.5  0.5
!
assign (resid 99 and name HN)(resid 4 and name O       ) 2.1  0.6  0.5
assign (resid 99 and name  N)(resid 4 and name O       ) 3.0  0.5  0.5
!
assign (resid 100 and name HN)(resid 43 and name O     ) 2.1  0.6  1.0
assign (resid 100 and name  N)(resid 43 and name O     ) 3.0  0.5  1.0
!
assign (resid 106 and name HN)(resid 102 and name O    ) 2.1  0.6  1.0
assign (resid 106 and name  N)(resid 102 and name O    ) 3.0  0.5  1.0
!
assign (resid 108 and name HN)(resid 104 and name O    ) 2.1  0.6  1.0
assign (resid 108 and name  N)(resid 104 and name O    ) 3.0  0.5  1.0
!
assign (resid 110 and name HN)(resid 106 and name O    ) 2.1  0.6  1.0
assign (resid 110 and name  N)(resid 106 and name O    ) 3.0  0.5  1.0
!
assign (resid 117 and name HN)(resid 5 and name O      ) 2.1  0.6  1.0
assign (resid 117 and name  N)(resid 5 and name O      ) 3.0  0.5  1.0
!
assign (resid 120 and name HN)(resid 151 and name O    ) 2.1  0.6  0.5
assign (resid 120 and name  N)(resid 151 and name O    ) 3.0  0.5  0.5
!
assign (resid 142 and name HN)(resid 154 and name O    ) 2.1  0.6  0.5
assign (resid 142 and name  N)(resid 154 and name O    ) 3.0  0.5  0.5
!
assign (resid 145 and name HN)(resid 152 and name O    ) 2.1  0.6  0.5
assign (resid 145 and name  N)(resid 152 and name O    ) 3.0  0.5  0.5
!
assign (resid 147 and name HN)(resid 150 and name O    ) 2.1  0.6  0.5
assign (resid 147 and name  N)(resid 150 and name O    ) 3.0  0.5  0.5
!
assign (resid 151 and name HN)(resid 120 and name O    ) 2.1  0.6  0.5
assign (resid 151 and name  N)(resid 120 and name O    ) 3.0  0.5  0.5
!
assign (resid 154 and name HN)(resid 143 and name O    ) 2.1  0.6  0.5
assign (resid 154 and name  N)(resid 143 and name O    ) 3.0  0.5  0.5
!
assign (resid 155 and name HN)(resid 116 and name O    ) 2.1  0.6  0.5
assign (resid 155 and name  N)(resid 116 and name O    ) 3.0  0.5  0.5
!
assign (resid 156 and name HN)(resid 140 and name O    ) 2.1  0.6  0.5
assign (resid 156 and name  N)(resid 140 and name O    ) 3.0  0.5  0.5
!

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

Contact the webmaster for help, if required. Monday, July 1, 2024 10:55:33 PM GMT (wattos1)

image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype	subsubtype
	23783	2jyb	cing	1-original	3	XPLOR/CNS	distance	hydrogen bond	simple