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

9102 1nd9 5624 cing recoord 1-original 2 XPLOR/CNS distance hydrogen bond simple

{ hydrogen bonds in regular alpha helices and beta sheets are
  defined using distance restraints  }

{ *****  link strand  3-6 to 35-38  antiparallel  ***** }

assign (resid   2 and name o  )    (resid  39 and name hn)    2.15 0.25 0.25
assign (resid   2 and name c  )    (resid  39 and name  n)    4.35 0.25 0.25
assign (resid   2 and name o  )    (resid  39 and name  n)    3.14 0.25 0.25
assign (resid   2 and name c  )    (resid  39 and name hn)    3.38 0.25 0.25
 
assign (resid   4 and name o  )    (resid  37 and name hn)    2.15 0.25 0.25
assign (resid   4 and name c  )    (resid  37 and name  n)    4.35 0.25 0.25
assign (resid   4 and name o  )    (resid  37 and name  n)    3.14 0.25 0.25
assign (resid   4 and name c  )    (resid  37 and name hn)    3.38 0.25 0.25
 
assign (resid  37 and name o  )    (resid   4 and name hn)    2.15 0.25 0.25
assign (resid  37 and name c  )    (resid   4 and name  n)    4.35 0.25 0.25
assign (resid  37 and name o  )    (resid   4 and name  n)    3.14 0.25 0.25
assign (resid  37 and name c  )    (resid   4 and name hn)    3.38 0.25 0.25
 
assign (resid   6 and name o  )    (resid  35 and name hn)    2.15 0.25 0.25
assign (resid   6 and name c  )    (resid  35 and name  n)    4.35 0.25 0.25
assign (resid   6 and name o  )    (resid  35 and name  n)    3.14 0.25 0.25
assign (resid   6 and name c  )    (resid  35 and name hn)    3.38 0.25 0.25
 
assign (resid  35 and name o  )    (resid   6 and name hn)    2.15 0.25 0.25
assign (resid  35 and name c  )    (resid   6 and name  n)    4.35 0.25 0.25
assign (resid  35 and name o  )    (resid   6 and name  n)    3.14 0.25 0.25
assign (resid  35 and name c  )    (resid   6 and name hn)    3.38 0.25 0.25

{ ******  helix alpha 8 to 13 ***** } 
 
assign (resid  9 and name o  )    (resid 13 and name hn)    2.15 0.25 0.25
assign (resid  9 and name c  )    (resid 13 and name  n)    4.35 0.25 0.25
assign (resid  9 and name o  )    (resid 13 and name  n)    3.14 0.25 0.25
assign (resid  9 and name c  )    (resid 13 and name hn)    3.38 0.25 0.25


{ ******  helix alpha 16 to 26 ***** }
 
assign (resid 17 and name o  )    (resid 21 and name hn)    2.15 0.25 0.25
assign (resid 17 and name c  )    (resid 21 and name  n)    4.35 0.25 0.25
assign (resid 17 and name o  )    (resid 21 and name  n)    3.14 0.25 0.25
assign (resid 17 and name c  )    (resid 21 and name hn)    3.38 0.25 0.25

assign (resid 18 and name o  )    (resid 22 and name hn)    2.15 0.25 0.25
assign (resid 18 and name c  )    (resid 22 and name  n)    4.35 0.25 0.25
assign (resid 18 and name o  )    (resid 22 and name  n)    3.14 0.25 0.25
assign (resid 18 and name c  )    (resid 22 and name hn)    3.38 0.25 0.25
 
assign (resid 19 and name o  )    (resid 23 and name hn)    2.15 0.25 0.25
assign (resid 19 and name c  )    (resid 23 and name  n)    4.35 0.25 0.25
assign (resid 19 and name o  )    (resid 23 and name  n)    3.14 0.25 0.25
assign (resid 19 and name c  )    (resid 23 and name hn)    3.38 0.25 0.25

assign (resid 20 and name o  )    (resid 24 and name hn)    2.15 0.25 0.25
assign (resid 20 and name c  )    (resid 24 and name  n)    4.35 0.25 0.25
assign (resid 20 and name o  )    (resid 24 and name  n)    3.14 0.25 0.25
assign (resid 20 and name c  )    (resid 24 and name hn)    3.38 0.25 0.25
 
assign (resid 21 and name o  )    (resid 25 and name hn)    2.15 0.25 0.25
assign (resid 21 and name c  )    (resid 25 and name  n)    4.35 0.25 0.25
assign (resid 21 and name o  )    (resid 25 and name  n)    3.14 0.25 0.25
assign (resid 21 and name c  )    (resid 25 and name hn)    3.38 0.25 0.25

assign (resid 22 and name o  )    (resid 26 and name hn)    2.15 0.25 0.25
assign (resid 22 and name c  )    (resid 26 and name  n)    4.35 0.25 0.25
assign (resid 22 and name o  )    (resid 26 and name  n)    3.14 0.25 0.25
assign (resid 22 and name c  )    (resid 26 and name hn)    3.38 0.25 0.25


{ ******  helix alpha 43 to 50 ***** }    


assign (resid 44 and name o  )    (resid 48 and name hn)    2.15 0.25 0.25
assign (resid 44 and name c  )    (resid 48 and name  n)    4.35 0.25 0.25
assign (resid 44 and name o  )    (resid 48 and name  n)    3.14 0.25 0.25
assign (resid 44 and name c  )    (resid 48 and name hn)    3.38 0.25 0.25

assign (resid 45 and name o  )    (resid 49 and name hn)    2.15 0.25 0.25
assign (resid 45 and name c  )    (resid 49 and name  n)    4.35 0.25 0.25
assign (resid 45 and name o  )    (resid 49 and name  n)    3.14 0.25 0.25
assign (resid 45 and name c  )    (resid 49 and name hn)    3.38 0.25 0.25

assign (resid 46 and name o  )    (resid 50 and name hn)    2.15 0.25 0.25
assign (resid 46 and name c  )    (resid 50 and name  n)    4.35 0.25 0.25
assign (resid 46 and name o  )    (resid 50 and name  n)    3.14 0.25 0.25
assign (resid 46 and name c  )    (resid 50 and name hn)    3.38 0.25 0.25

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Contact the webmaster for help, if required. Friday, May 10, 2024 4:21:52 AM GMT (wattos1)

image	mrblock_id	pdb_id	bmrb_id	cing	in_recoord	stage	position	program	type	subtype	subsubtype
	9102	1nd9	5624	cing	recoord	1-original	2	XPLOR/CNS	distance	hydrogen bond	simple