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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15487 |
1ycw   |
cing | 1-original | 1 | 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 the AP2-1 duplex
remarks C1-G13
assign (resid 1 and name N3 and segid STR1 )
(resid 13 and name H1 and segid STR2 ) 1.940 0.10 0.10
assign (resid 1 and name H42 and segid STR1 )
(resid 13 and name O6 and segid STR2 ) 1.900 0.10 0.10
assign (resid 1 and name O2 and segid STR1 )
(resid 13 and name H22 and segid STR2 ) 1.840 0.10 0.10
remarks G2-C12
assign (resid 2 and name H1 and segid STR1 )
(resid 12 and name N3 and segid STR2 ) 1.940 0.10 0.10
assign (resid 2 and name O6 and segid STR1 )
(resid 12 and name H42 and segid STR2 ) 1.900 0.10 0.10
assign (resid 2 and name H22 and segid STR1 )
(resid 12 and name O2 and segid STR2 ) 1.840 0.10 0.10
remarks C3-G11
assign (resid 3 and name N3 and segid STR1 )
(resid 11 and name H1 and segid STR2 ) 1.940 0.10 0.10
assign (resid 3 and name H42 and segid STR1 )
(resid 11 and name O6 and segid STR2 ) 1.900 0.10 0.10
assign (resid 3 and name O2 and segid STR1 )
(resid 11 and name H22 and segid STR2 ) 1.840 0.10 0.10
remarks A4-T10
assign (resid 4 and name N1 and segid STR1 )
(resid 10 and name H3 and segid STR2 ) 1.810 0.10 0.10
assign (resid 4 and name H61 and segid STR1 )
(resid 10 and name O4 and segid STR2 ) 1.840 0.10 0.10
remarks T5-A9
assign (resid 5 and name H3 and segid STR1 )
(resid 9 and name N1 and segid STR2 ) 1.810 0.10 0.10
assign (resid 5 and name O4 and segid STR1 )
(resid 9 and name H61 and segid STR2 ) 1.840 0.10 0.10
remarks T9-A5
assign (resid 9 and name H3 and segid STR1 )
(resid 5 and name N1 and segid STR2 ) 1.810 0.10 0.10
assign (resid 9 and name O4 and segid STR1 )
(resid 5 and name H61 and segid STR2 ) 1.840 0.10 0.10
remarks A10-T4
assign (resid 10 and name N1 and segid STR1 )
(resid 4 and name H3 and segid STR2 ) 1.810 0.10 0.10
assign (resid 10 and name H61 and segid STR1 )
(resid 4 and name O4 and segid STR2 ) 1.840 0.10 0.10
remarks G6-C7
assign (resid 6 and name H1 and segid STR1 )
(resid 7 and name N3 and segid STR2 ) 1.940 0.10 0.10
assign (resid 6 and name O6 and segid STR1 )
(resid 7 and name H42 and segid STR2 ) 1.900 0.10 0.10
assign (resid 6 and name H22 and segid STR1 )
(resid 7 and name O2 and segid STR2 ) 1.840 0.10 0.10
remarks G8-C6
assign (resid 8 and name H1 and segid STR1 )
(resid 6 and name N3 and segid STR2 ) 1.940 0.10 0.10
assign (resid 8 and name O6 and segid STR1 )
(resid 6 and name H42 and segid STR2 ) 1.900 0.10 0.10
assign (resid 8 and name H22 and segid STR1 )
(resid 6 and name O2 and segid STR2 ) 1.840 0.10 0.10
remarks C11-G3
assign (resid 11 and name N3 and segid STR1 )
(resid 3 and name H1 and segid STR2 ) 1.940 0.10 0.10
assign (resid 11 and name H42 and segid STR1 )
(resid 3 and name O6 and segid STR2 ) 1.900 0.10 0.10
assign (resid 11 and name O2 and segid STR1 )
(resid 3 and name H22 and segid STR2 ) 1.840 0.10 0.10
remarks G12-C2
assign (resid 12 and name H1 and segid STR1 )
(resid 2 and name N3 and segid STR2 ) 1.940 0.10 0.10
assign (resid 12 and name O6 and segid STR1 )
(resid 2 and name H42 and segid STR2 ) 1.900 0.10 0.10
assign (resid 12 and name H22 and segid STR1 )
(resid 2 and name O2 and segid STR2 ) 1.840 0.10 0.10
remarks C13-G1
assign (resid 13 and name N3 and segid STR1 )
(resid 1 and name H1 and segid STR2 ) 1.940 0.10 0.10
assign (resid 13 and name H42 and segid STR1 )
(resid 1 and name O6 and segid STR2 ) 1.900 0.10 0.10
assign (resid 13 and name O2 and segid STR1 )
(resid 1 and name H22 and segid STR2 ) 1.840 0.10 0.10
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