NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype subsubtype

481075 1saf cing 3-converted-DOCR XPLOR/CNS distance hydrogen bond ambi
 assi 
   (( segid "   A" and resid 337  and name  NH2 ))
   (( segid "   C" and resid 352  and name  OD2 ))
      3.000     0.700     0.500
 or   
   (( segid "   A" and resid 337  and name  NH2 ))
   (( segid "   C" and resid 352  and name  OD1 ))
 or   
   (( segid "   A" and resid 337  and name  NH1 ))
   (( segid "   C" and resid 352  and name  OD1 ))
 or   
   (( segid "   A" and resid 337  and name  NH1 ))
   (( segid "   C" and resid 352  and name  OD2 ))

 assi 
   (  segid "   A" and resid 337  and name  HH1#)
   (( segid "   C" and resid 352  and name  OD1 ))
      2.000     0.700     0.500
 or   
   (  segid "   A" and resid 337  and name  HH1#)
   (( segid "   C" and resid 352  and name  OD2 ))
 or   
   (  segid "   A" and resid 337  and name  HH2#)
   (( segid "   C" and resid 352  and name  OD2 ))
 or   
   (  segid "   A" and resid 337  and name  HH2#)
   (( segid "   C" and resid 352  and name  OD1 ))

 assi 
   (( segid "   C" and resid 334  and name  N   ))
   (( segid "   A" and resid 326  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   C" and resid 334  and name  HN  ))
   (( segid "   A" and resid 326  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   C" and resid 332  and name  N   ))
   (( segid "   A" and resid 328  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   C" and resid 332  and name  HN  ))
   (( segid "   A" and resid 328  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   C" and resid 328  and name  N   ))
   (( segid "   A" and resid 332  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   C" and resid 328  and name  HN  ))
   (( segid "   A" and resid 332  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   C" and resid 330  and name  N   ))
   (( segid "   A" and resid 330  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   C" and resid 330  and name  HN  ))
   (( segid "   A" and resid 330  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   C" and resid 337  and name  NH2 ))
   (( segid "   A" and resid 352  and name  OD2 ))
      3.000     0.700     0.500
 or   
   (( segid "   C" and resid 337  and name  NH2 ))
   (( segid "   A" and resid 352  and name  OD1 ))
 or   
   (( segid "   C" and resid 337  and name  NH1 ))
   (( segid "   A" and resid 352  and name  OD2 ))
 or   
   (( segid "   C" and resid 337  and name  NH1 ))
   (( segid "   A" and resid 352  and name  OD1 ))

 assi 
   (  segid "   C" and resid 337  and name  HH1#)
   (( segid "   A" and resid 352  and name  OD2 ))
      2.000     0.700     0.500
 or   
   (  segid "   C" and resid 337  and name  HH1#)
   (( segid "   A" and resid 352  and name  OD1 ))
 or   
   (  segid "   C" and resid 337  and name  HH2#)
   (( segid "   A" and resid 352  and name  OD2 ))
 or   
   (  segid "   C" and resid 337  and name  HH2#)
   (( segid "   A" and resid 352  and name  OD1 ))

 assi 
   (( segid "   B" and resid 334  and name  N   ))
   (( segid "   D" and resid 326  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   B" and resid 334  and name  HN  ))
   (( segid "   D" and resid 326  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   B" and resid 332  and name  N   ))
   (( segid "   D" and resid 328  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   B" and resid 332  and name  HN  ))
   (( segid "   D" and resid 328  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   B" and resid 328  and name  N   ))
   (( segid "   D" and resid 332  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   B" and resid 328  and name  HN  ))
   (( segid "   D" and resid 332  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   B" and resid 330  and name  N   ))
   (( segid "   D" and resid 330  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   B" and resid 330  and name  HN  ))
   (( segid "   D" and resid 330  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   B" and resid 337  and name  NH1 ))
   (( segid "   D" and resid 352  and name  OD2 ))
      3.000     0.700     0.500
 or   
   (( segid "   B" and resid 337  and name  NH2 ))
   (( segid "   D" and resid 352  and name  OD2 ))
 or   
   (( segid "   B" and resid 337  and name  NH2 ))
   (( segid "   D" and resid 352  and name  OD1 ))
 or   
   (( segid "   B" and resid 337  and name  NH1 ))
   (( segid "   D" and resid 352  and name  OD1 ))

 assi 
   (  segid "   B" and resid 337  and name  HH1#)
   (( segid "   D" and resid 352  and name  OD1 ))
      2.000     0.700     0.500
 or   
   (  segid "   B" and resid 337  and name  HH1#)
   (( segid "   D" and resid 352  and name  OD2 ))
 or   
   (  segid "   B" and resid 337  and name  HH2#)
   (( segid "   D" and resid 352  and name  OD2 ))
 or   
   (  segid "   B" and resid 337  and name  HH2#)
   (( segid "   D" and resid 352  and name  OD1 ))

 assi 
   (( segid "   D" and resid 334  and name  N   ))
   (( segid "   B" and resid 326  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   D" and resid 334  and name  HN  ))
   (( segid "   B" and resid 326  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   D" and resid 332  and name  N   ))
   (( segid "   B" and resid 328  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   D" and resid 332  and name  HN  ))
   (( segid "   B" and resid 328  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   D" and resid 328  and name  N   ))
   (( segid "   B" and resid 332  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   D" and resid 328  and name  HN  ))
   (( segid "   B" and resid 332  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   D" and resid 330  and name  N   ))
   (( segid "   B" and resid 330  and name  O   ))
      3.000     0.700     0.500

 assi 
   (( segid "   D" and resid 330  and name  HN  ))
   (( segid "   B" and resid 330  and name  O   ))
      2.000     0.700     0.500

 assi 
   (( segid "   D" and resid 337  and name  NH2 ))
   (( segid "   B" and resid 352  and name  OD2 ))
      3.000     0.700     0.500
 or   
   (( segid "   D" and resid 337  and name  NH2 ))
   (( segid "   B" and resid 352  and name  OD1 ))
 or   
   (( segid "   D" and resid 337  and name  NH1 ))
   (( segid "   B" and resid 352  and name  OD2 ))
 or   
   (( segid "   D" and resid 337  and name  NH1 ))
   (( segid "   B" and resid 352  and name  OD1 ))

 assi 
   (  segid "   D" and resid 337  and name  HH1#)
   (( segid "   B" and resid 352  and name  OD2 ))
      2.000     0.700     0.500
 or   
   (  segid "   D" and resid 337  and name  HH1#)
   (( segid "   B" and resid 352  and name  OD1 ))
 or   
   (  segid "   D" and resid 337  and name  HH2#)
   (( segid "   B" and resid 352  and name  OD2 ))
 or   
   (  segid "   D" and resid 337  and name  HH2#)
   (( segid "   B" and resid 352  and name  OD1 ))
Please acknowledge these references in publications where the data from this site have been utilized.
Contact the webmaster for help, if required. Thursday, May 16, 2024 4:52:13 AM GMT (wattos1)
image	mrblock_id	pdb_id	cing	stage	program	type	subtype	subsubtype
	481075	1saf	cing	3-converted-DOCR	XPLOR/CNS	distance	hydrogen bond	ambi