NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
456435 |
2kuh   |
16764 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
!Protein-ligand NOE Restraints (A:calmodulin, B: halothnane)
!
assign (segid A and resid 105 and name HD1* )
(segid B and resid 150 and name H4 ) 4.50 1.00 1.50
assign (segid A and resid 105 and name HD2* )
(segid B and resid 150 and name H4 ) 5.00 1.00 1.50
assign (segid A and resid 108 and name HG1* )
(segid B and resid 150 and name H4 ) 6.00 1.50 2.00
assign (segid A and resid 109 and name HE* )
(segid B and resid 150 and name H4 ) 5.00 1.00 1.50
assign (segid A and resid 112 and name HD1* )
(segid B and resid 150 and name H4 ) 6.00 1.50 2.00
assign (segid A and resid 112 and name HD2* )
(segid B and resid 150 and name H4 ) 6.00 1.50 2.00
assign (segid A and resid 124 and name HE* )
(segid B and resid 150 and name H4 ) 5.00 1.00 1.50
assign (segid A and resid 128 and name HB* )
(segid B and resid 150 and name H4 ) 5.00 1.00 1.50
assign (segid A and resid 144 and name HE* )
(segid B and resid 150 and name H4 ) 6.00 1.50 2.00
assign (segid A and resid 145 and name HE* )
(segid B and resid 150 and name H4 ) 5.00 1.00 1.50
!repulse
assign (segid A and resid 89 and name HD1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 89 and name HE1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 92 and name HD1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 92 and name HE1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 99 and name HD1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 99 and name HE1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 89 and name HD2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 89 and name HE2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 92 and name HD2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 92 and name HE2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 99 and name HD2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 99 and name HE2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 109 and name HB1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 109 and name HB2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 109 and name HG1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 109 and name HG2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 109 and name HA )
(segid B and resid 150 and name H4 ) 4.50 0.10 20.00
assign (segid A and resid 100 and name HD* )
(segid B and resid 150 and name H4 ) 5.00 0.10 20.00
assign (segid A and resid 114 and name HG* )
(segid B and resid 150 and name H4 ) 5.00 0.10 20.00
assign (segid A and resid 116 and name HD* )
(segid B and resid 150 and name H4 ) 5.00 0.10 20.00
assign (segid A and resid 124 and name HB1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 124 and name HB2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 124 and name HG1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 124 and name HG2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 124 and name HA )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 136 and name HG1* )
(segid B and resid 150 and name H4 ) 5.00 0.10 20.00
assign (segid A and resid 136 and name HG2* )
(segid B and resid 150 and name H4 ) 5.00 0.10 20.00
assign (segid A and resid 141 and name HD1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 141 and name HE1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 141 and name HD2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 141 and name HE2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 144 and name HB1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 144 and name HB2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 144 and name HG1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 144 and name HG2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 145 and name HA )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 145 and name HB1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 145 and name HB2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 145 and name HG1 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
assign (segid A and resid 145 and name HG2 )
(segid B and resid 150 and name H4 ) 4.00 0.10 20.00
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