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

4346 1f5u cing 1-original 8 XPLOR/CNS distance hydrogen bond simple
 {base pair G1-C18}
assign (segid RRRR and residue 18 and name h41)(segid RRRR and residue 1 and name o6) 1.7 .1 .1
assign (segid RRRR and residue 18 and name n3)(segid RRRR and residue 1 and name h21) 3.0 .1 .1
assign (segid RRRR and residue 18 and name o2)(segid RRRR and residue 1 and name h21) 2.0 .1 .1
assign (segid RRRR and residue 18 and name n3)(segid RRRR and residue 1 and name h1) 1.9 .1 .1
assign (segid RRRR and residue 18 and name n3)(segid RRRR and residue 1 and name n1) 2.9 .1 .1

{base pair G2-C17}
assign (segid RRRR and residue 17 and name h41)(segid RRRR and residue 2 and name o6) 1.7 .1 .1
assign (segid RRRR and residue 17 and name n3)(segid RRRR and residue 2 and name h21) 3.0 .1 .1
assign (segid RRRR and residue 17 and name o2)(segid RRRR and residue 2 and name h21) 2.0 .1 .1
assign (segid RRRR and residue 17 and name n3)(segid RRRR and residue 2 and name h1) 1.9 .1 .1
assign (segid RRRR and residue 17 and name n3)(segid RRRR and residue 2 and name n1) 2.9 .1 .1      

{base pairing U3-A16}
assign (segid RRRR and residue 16 and name h2)(segid RRRR and residue 3 and name o2) 3.2 .1 .1  {1.7 1.7 .1}
assign (segid RRRR and residue 16 and name n1)(segid RRRR and residue 3 and name h3) 1.9 .1 .1  {3.0 .1 .1}
assign (segid RRRR and residue 16 and name h61)(segid RRRR and residue 3 and name o4) 1.8 .1 .1 {2.0 .1 .1}
assign (segid RRRR and residue 16 and name h2)(segid RRRR and residue 3 and name h3) 2.9 .1 .1  {1.9 .1 .1} 
assign (segid RRRR and residue 16 and name n1)(segid RRRR and residue 3 and name n3) 2.9 .1 .1 
       
      {base pair G4-C15}
assign (segid RRRR and residue 15 and name h41)(segid RRRR and residue 4 and name o6) 1.7 .1 .1
assign (segid RRRR and residue 15 and name n3)(segid RRRR and residue 4 and name h21) 3.0 .1 .1
assign (segid RRRR and residue 15 and name o2)(segid RRRR and residue 4 and name h21) 2.0 .1 .1
assign (segid RRRR and residue 15 and name n3)(segid RRRR and residue 4 and name h1) 1.9 .1 .1 
assign (segid RRRR and residue 15 and name n3)(segid RRRR and residue 4 and name n1) 2.9 .1 .1 
 
      {base pair G5-C14}
assign (segid RRRR and residue 14 and name h41)(segid RRRR and residue 5 and name o6) 1.7 .1 .1
assign (segid RRRR and residue 14 and name n3)(segid RRRR and residue 5 and name h21) 3.0 .1 .1
assign (segid RRRR and residue 14 and name o2)(segid RRRR and residue 5 and name h21) 2.0 .1 .1
assign (segid RRRR and residue 14 and name n3)(segid RRRR and residue 5 and name h1) 1.9 .1 .1 
assign (segid RRRR and residue 14 and name n3)(segid RRRR and residue 5 and name n1) 2.9 .1 .1        

      {base pair G6-C13}
assign (segid RRRR and residue 13 and name h41)(segid RRRR and residue 6 and name o6) 1.7 .1 .1
assign (segid RRRR and residue 13 and name n3)(segid RRRR and residue 6 and name h21) 3.0 .1 .1
assign (segid RRRR and residue 13 and name o2)(segid RRRR and residue 6 and name h21) 2.0 .1 .1
assign (segid RRRR and residue 13 and name n3)(segid RRRR and residue 6 and name h1) 1.9 .1 .1 
assign (segid RRRR and residue 13 and name n3)(segid RRRR and residue 6 and name n1) 2.9 .1 .1       
 
      {base pair A7-U12}
assign (segid RRRR and residue 7 and name h2)(segid RRRR and residue 12 and name o2) 3.2 .1 .1  {1.7 1.7 .1}
assign (segid RRRR and residue 7 and name n1)(segid RRRR and residue 12 and name h3) 1.9 .1 .1 {3.0 .1 .1}
assign (segid RRRR and residue 7 and name h61)(segid RRRR and residue 12 and name o4) 1.8 .1 .1 {2.0 .1 .1}
assign (segid RRRR and residue 7 and name h2)(segid RRRR and residue 12 and name h3) 2.9 .1 .1 {1.9 .1 .1}
assign (segid RRRR and residue 7 and name n1)(segid RRRR and residue 12 and name n3) 2.9 .1 .1


 {DISTANCE RESTRICTIONS FOR EXCHANGEABLE PROTONS FROM THE H2O NOESY}

{from 300ms and 200ms H2O NOESY at 20c and 100ms H2O NOESY at 10c}
  {imino proton to imino proton}
assign (segid RRRR and residue 2 and name h1)(segid RRRR and residue 3 and name h3) 1.8 0 3.2
assign (segid RRRR and residue 3 and name h3)(segid RRRR and residue 4 and name h1) 1.8 0 3.2
assign (segid RRRR and residue 4 and name h1)(segid RRRR and residue 5 and name h1) 1.8 0 3.2
assign (segid RRRR and residue 5 and name h1)(segid RRRR and residue 6 and name h1) 1.8 0 3.2
assign (segid RRRR and residue 6 and name h1)(segid RRRR and residue 12 and name h3) 1.8 0 3.2
assign (segid RRRR and residue 12 and name h3)(segid RRRR and residue 8 and name h1) 1.8 0 3.2

  {imino proton to amino proton A h2 proton aromatic proton, or}
assign (segid RRRR and residue 2 and name h1)(segid RRRR and residue 17 and name h41) 1.8 0 3.2
assign (segid RRRR and residue 2 and name h1)(segid RRRR and residue 17 and name h42) 1.8 0 3.2
assign (segid RRRR and residue 3 and name h3)(segid RRRR and residue 16 and name h2) 1.8 0 3.2
assign (segid RRRR and residue 4 and name h1)(segid RRRR and residue 15 and name h41) 1.8 0 3.2
assign (segid RRRR and residue 4 and name h1)(segid RRRR and residue 15 and name h42) 1.8 0 3.2
assign (segid RRRR and residue 5 and name h1)(segid RRRR and residue 14 and name h41) 1.8 0 3.2 
assign (segid RRRR and residue 5 and name h1)(segid RRRR and residue 14 and name h42) 1.8 0 3.2
assign (segid RRRR and residue 6 and name h1)(segid RRRR and residue 13 and name h41) 1.8 0 3.2
assign (segid RRRR and residue 6 and name h1)(segid RRRR and residue 13 and name h42) 1.8 0 3.2
assign (segid RRRR and residue 6 and name h1)(segid RRRR and residue 7 and name h2) 1.8 0 3.2
assign (segid RRRR and residue 12 and name h3)(segid RRRR and residue 7 and name h2) 1.8 0 3.2
assign (segid RRRR and residue 12 and name h3)(segid RRRR and residue 7 and name h61) 1.8 0 3.2 
assign (segid RRRR and residue 12 and name h3)(segid RRRR and residue 7 and name h62) 1.8 0 3.2
assign (segid RRRR and residue 12 and name h3)(segid RRRR and residue 13 and name h41) 1.8 0 3.2
assign (segid RRRR and residue 12 and name h3)(segid RRRR and residue 13 and name h42) 1.8 0 3.2
{assign (segid RRRR and residue 11 and name h1)(segid RRRR and residue 11 and name h1') 1.8 0 3.2} 
assign (segid RRRR and residue 8 and name h1)(segid RRRR and residue 8 and name h21) 1.8 0 3.2
assign (segid RRRR and residue 8 and name h1)(segid RRRR and residue 8 and name h22) 1.8 0 3.2
assign (segid RRRR and residue 8 and name h1)(segid RRRR and residue 10 and name h6) 1.8 0 3.2
assign (segid RRRR and residue 8 and name h1)(segid RRRR and residue 11 and name h8) 1.8 0 3.2
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image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype	subsubtype
	4346	1f5u	cing	1-original	8	XPLOR/CNS	distance	hydrogen bond	simple