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
8682 1mp7 cing 1-original 4 XPLOR/CNS distance hydrogen bond simple


remark W-C related restraints
remark fixed distance constraints of Watson Crick hydrogen bonds

remark resid 1  G 10mer
remark resid 2  C 10mer
remark resid 3  C 10mer
remark resid 4  A 10mer
remark resid 5  G 10mer
remark resid 6  A 10mer
remark resid 7  G 10mer
remark resid 8  A 10mer
remark resid 9  G 10mer
remark resid 10 C 10mer

remark W-C bonds  Proton to Acceptor fixed distances
remark         C                         G     

assign (resid  10 and name H42 ) (resid   1 and name O6  )  1.95  0.2   0.3 
assign (resid   2 and name H42 ) (resid   9 and name O6  )  1.95  0.2   0.3 
assign (resid   3 and name H42 ) (resid   7 and name O6  )  1.95  0.2   0.3 

assign (resid  10 and name  O2 ) (resid   1 and name H22 )  1.95  0.2   0.3 
assign (resid   2 and name  O2 ) (resid   9 and name H22 )  1.95  0.2   0.3 
assign (resid   3 and name  O2 ) (resid   7 and name H22 )  1.95  0.2   0.3 

assign (resid  10 and name  N3 ) (resid   1 and name H1  )  1.95  0.2   0.3 
assign (resid   2 and name  N3 ) (resid   9 and name H1  )  1.95  0.2   0.3 
assign (resid   3 and name  N3 ) (resid   7 and name H1  )  1.95  0.2   0.3 

remark fixed distances between donor and acceptor of H bonds
remark         C                         G     

assign (resid  10 and name  N4 ) (resid   1 and name O6  )  2.95  0.35  0.25
assign (resid   2 and name  N4 ) (resid   9 and name O6  )  2.95  0.35  0.25
assign (resid   3 and name  N4 ) (resid   7 and name O6  )  2.95  0.35  0.25

assign (resid  10 and name  O2 ) (resid   1 and name N2  )  2.95  0.35  0.25
assign (resid   2 and name  O2 ) (resid   9 and name N2  )  2.95  0.35  0.25
assign (resid   3 and name  O2 ) (resid   7 and name N2  )  2.95  0.35  0.25

assign (resid  10 and name  N3 ) (resid   1 and name N1  )  2.90  0.25  0.35
assign (resid   2 and name  N3 ) (resid   9 and name N1  )  2.90  0.25  0.35
assign (resid   3 and name  N3 ) (resid   7 and name N1  )  2.90  0.25  0.35



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