NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
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20746 |
2ge2   |
cing | 1-original | 2 | XPLOR/CNS | distance | hydrogen bond | simple |
remarks h-bond restraints for the imino and amino groups
remarks done a la noe constraints (ME & DN)
remarks Rewritten from David's file which was rewritten
remarks from Carlos de los Santos' file aaf.hb to fit
remarks my own sequence. -JMB
! SDG
! C1 G2 T3 A4 C5 G6 C7 A8 T9 G10 C11
! G11 C10 A9 T8 G7 C6 G5 T4 A3 C2 G1
remarks C1-G11
assign (resid 1 and name N3 and segid SEG1 )
(resid 11 and name H1 and segid SEG2 ) 1.940 0.10 0.10
assign (resid 1 and name H42 and segid SEG1 )
(resid 11 and name O6 and segid SEG2 ) 1.900 0.10 0.10
assign (resid 1 and name O2 and segid SEG1 )
(resid 11 and name H22 and segid SEG2 ) 1.840 0.10 0.10
remarks G2-C10
assign (resid 2 and name H1 and segid SEG1 )
(resid 10 and name N3 and segid SEG2 ) 1.940 0.10 0.10
assign (resid 2 and name O6 and segid SEG1 )
(resid 10 and name H42 and segid SEG2 ) 1.900 0.10 0.10
assign (resid 2 and name H22 and segid SEG1 )
(resid 10 and name O2 and segid SEG2 ) 1.840 0.10 0.10
remarks T3-A9
assign (resid 3 and name H3 and segid SEG1 )
(resid 9 and name N1 and segid SEG2 ) 1.810 0.10 0.10
assign (resid 3 and name O4 and segid SEG1 )
(resid 9 and name H61 and segid SEG2 ) 1.840 0.10 0.10
remarks A4-T8
assign (resid 4 and name N1 and segid SEG1 )
(resid 8 and name H3 and segid SEG2 ) 1.810 0.10 0.10
assign (resid 4 and name H61 and segid SEG1 )
(resid 8 and name O4 and segid SEG2 ) 1.840 0.10 0.10
remarks C5-G7
assign (resid 5 and name N3 and segid SEG1 )
(resid 7 and name H1 and segid SEG2 ) 1.940 0.50 0.50
assign (resid 5 and name O2 and segid SEG1 )
(resid 7 and name H22 and segid SEG2 ) 1.840 0.50 0.50
assign (resid 5 and name H42 and segid SEG1 )
(resid 7 and name O6 and segid SEG2 ) 1.900 0.50 0.50
remarks G6-C6
assign (resid 6 and name H1 and segid SEG1 )
(resid 6 and name N3 and segid SEG2 ) 1.940 0.10 0.10
assign (resid 6 and name O6 and segid SEG1 )
(resid 6 and name H42 and segid SEG2 ) 1.900 0.10 0.10
assign (resid 6 and name H22 and segid SEG1 )
(resid 6 and name O2 and segid SEG2 ) 1.840 0.10 0.10
remarks C7-G5
assign (resid 7 and name N3 and segid SEG1 )
(resid 5 and name H1 and segid SEG2 ) 1.940 0.50 0.50
assign (resid 7 and name H42 and segid SEG1 )
(resid 5 and name O6 and segid SEG2 ) 1.900 0.50 0.50
assign (resid 7 and name O2 and segid SEG1 )
(resid 5 and name H22 and segid SEG2 ) 1.840 0.50 0.50
remarks A8-T4
assign (resid 8 and name N1 and segid SEG1 )
(resid 4 and name H3 and segid SEG2 ) 1.810 0.10 0.10
assign (resid 8 and name H61 and segid SEG1 )
(resid 4 and name O4 and segid SEG2 ) 1.840 0.10 0.10
remarks T9-A3
assign (resid 9 and name H3 and segid SEG1 )
(resid 3 and name N1 and segid SEG2 ) 1.810 0.10 0.10
assign (resid 9 and name O4 and segid SEG1 )
(resid 3 and name H61 and segid SEG2 ) 1.840 0.10 0.10
remarks G10-C2
assign (resid 10 and name H1 and segid SEG1 )
(resid 2 and name N3 and segid SEG2 ) 1.940 0.10 0.10
assign (resid 10 and name O6 and segid SEG1 )
(resid 2 and name H42 and segid SEG2 ) 1.900 0.10 0.10
assign (resid 10 and name H22 and segid SEG1 )
(resid 2 and name O2 and segid SEG2 ) 1.840 0.10 0.10
remarks C11-G1
assign (resid 11 and name N3 and segid SEG1 )
(resid 1 and name H1 and segid SEG2 ) 1.940 0.10 0.10
assign (resid 11 and name H42 and segid SEG1 )
(resid 1 and name O6 and segid SEG2 ) 1.900 0.10 0.10
assign (resid 11 and name O2 and segid SEG1 )
(resid 1 and name H22 and segid SEG2 ) 1.840 0.10 0.10
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