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

515525 1e8l 1093 cing recoord 1-original 3 XPLOR/CNS distance hydrogen bond simple

! Hydrogen bond restraints

!* H-bonds in first helix.
ASSIGN (RESID  10    AND NAME HN   ) (RESID   6    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  10    AND NAME N    ) (RESID   6    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  11    AND NAME HN   ) (RESID   7    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  11    AND NAME N    ) (RESID   7    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  12    AND NAME HN   ) (RESID   8    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  12    AND NAME N    ) (RESID   8    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  13    AND NAME HN   ) (RESID   9    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  13    AND NAME N    ) (RESID   9    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  14    AND NAME HN   ) (RESID  10    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  14    AND NAME N    ) (RESID  10    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  15    AND NAME HN   ) (RESID  11    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  15    AND NAME N    ) (RESID  11    AND NAME O    )  2.8 0.5 0.5
!* H-bonds in second helix.
ASSIGN (RESID  29    AND NAME HN   ) (RESID  25    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  29    AND NAME N    ) (RESID  25    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  30    AND NAME HN   ) (RESID  26    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  30    AND NAME N    ) (RESID  26    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  31    AND NAME HN   ) (RESID  27    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  31    AND NAME N    ) (RESID  27    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  32    AND NAME HN   ) (RESID  28    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  32    AND NAME N    ) (RESID  28    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  33    AND NAME HN   ) (RESID  29    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  33    AND NAME N    ) (RESID  29    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  34    AND NAME HN   ) (RESID  30    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  34    AND NAME N    ) (RESID  30    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  35    AND NAME HN   ) (RESID  31    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  35    AND NAME N    ) (RESID  31    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  36    AND NAME HN   ) (RESID  32    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  36    AND NAME N    ) (RESID  32    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  37    AND NAME HN   ) (RESID  33    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  37    AND NAME N    ) (RESID  33    AND NAME O    )  2.8 0.5 0.5
!* H-bonds for third helix.
ASSIGN (RESID  93    AND NAME HN   ) (RESID  89    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  93    AND NAME N    ) (RESID  89    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  94    AND NAME HN   ) (RESID  90    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  94    AND NAME N    ) (RESID  90    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  95    AND NAME HN   ) (RESID  91    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  95    AND NAME N    ) (RESID  91    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  96    AND NAME HN   ) (RESID  92    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  96    AND NAME N    ) (RESID  92    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  97    AND NAME HN   ) (RESID  93    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  97    AND NAME N    ) (RESID  93    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  98    AND NAME HN   ) (RESID  94    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  98    AND NAME N    ) (RESID  94    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  99    AND NAME HN   ) (RESID  95    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  99    AND NAME N    ) (RESID  95    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID 100    AND NAME HN   ) (RESID  96    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID 100    AND NAME N    ) (RESID  96    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID 101    AND NAME HN   ) (RESID  97    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID 101    AND NAME N    ) (RESID  97    AND NAME O    )  2.8 0.5 0.5
!* H-bonds between strands 1 and 2.
ASSIGN (RESID  42    AND NAME O    ) (RESID  54    AND NAME HN   )  1.8 0.5 0.5
ASSIGN (RESID  42    AND NAME O    ) (RESID  54    AND NAME N    )  2.8 0.5 0.5
ASSIGN (RESID  44    AND NAME HN   ) (RESID  52    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  44    AND NAME N    ) (RESID  52    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  44    AND NAME O    ) (RESID  52    AND NAME HN   )  1.8 0.5 0.5
ASSIGN (RESID  44    AND NAME O    ) (RESID  52    AND NAME N    )  2.8 0.5 0.5
ASSIGN (RESID  46    AND NAME HN   ) (RESID  50    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  46    AND NAME N    ) (RESID  50    AND NAME O    )  2.8 0.5 0.5
!* H-bonds between strands 2 and 3.
ASSIGN (RESID  53    AND NAME HN   ) (RESID  58    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  53    AND NAME N    ) (RESID  58    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  53    AND NAME O    ) (RESID  58    AND NAME HN   )  1.8 0.5 0.5
ASSIGN (RESID  53    AND NAME O    ) (RESID  58    AND NAME N    )  2.8 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. Sunday, April 28, 2024 11:19:36 PM GMT (wattos1)

image	mrblock_id	pdb_id	bmrb_id	cing	in_recoord	stage	position	program	type	subtype	subsubtype
	515525	1e8l	1093	cing	recoord	1-original	3	XPLOR/CNS	distance	hydrogen bond	simple