NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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12547 |
1t2y   |
248 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
! noe.tbl ! NcMT set message=off echo=off end ! strong: 1.8 0.0 0.9, medium: 1.8 0.0 1.5, weak: 1.8 0.0 3.2 ! CH2 and CH3 groups added 0.5 A (e.g. strong to HB# was 1.4 upper) ! NH(i)-NH(j) assign (resid 4 and name HN )(resid 3 and name HN ) 1.8 0.0 0.9 assign (resid 4 and name HN )(resid 5 and name HN ) 1.8 0.0 0.9 assign (resid 6 and name HN )(resid 4 and name HN ) 1.8 0.0 3.2 assign (resid 6 and name HN )(resid 7 and name HN ) 1.8 0.0 0.9 assign (resid 6 and name HN )(resid 5 and name HN ) 1.8 0.0 3.2 assign (resid 7 and name HN )(resid 10 and name HN ) 1.8 0.0 3.2 assign (resid 8 and name HN )(resid 7 and name HN ) 1.8 0.0 3.2 assign (resid 8 and name HN )(resid 9 and name HN ) 1.8 0.0 1.5 assign (resid 9 and name HN )(resid 10 and name HN ) 1.8 0.0 1.5 assign (resid 10 and name HN )(resid 11 and name HN ) 1.8 0.0 0.9 assign (resid 13 and name HN )(resid 14 and name HN ) 1.8 0.0 0.9 assign (resid 13 and name HN )(resid 12 and name HN ) 1.8 0.0 0.9 assign (resid 15 and name HN )(resid 14 and name HN ) 1.8 0.0 3.2 assign (resid 16 and name HN )(resid 15 and name HN ) 1.8 0.0 3.2 assign (resid 16 and name HN )(resid 17 and name HN ) 1.8 0.0 1.5 assign (resid 19 and name HN )(resid 18 and name HN ) 1.8 0.0 0.9 assign (resid 20 and name HN )(resid 21 and name HN ) 1.8 0.0 3.2 assign (resid 21 and name HN )(resid 22 and name HN ) 1.8 0.0 1.5 assign (resid 23 and name HN )(resid 22 and name HN ) 1.8 0.0 0.9 assign (resid 24 and name HN )(resid 23 and name HN ) 1.8 0.0 1.5 ! NH(i)-any(j) assign (resid 21 and name HN )(resid 21 and name HD2# ) 1.8 0.0 3.7 !this restraint was a stereospecific restraint on an NH2 group !changed to HD2# and added 0.5 A assign (resid 2 and name HN )(resid 2 and name HB# ) 1.8 0.0 3.7 assign (resid 2 and name HN )(resid 2 and name HA ) 1.8 0.0 3.2 assign (resid 3 and name HN )(resid 2 and name HB# ) 1.8 0.0 2.0 assign (resid 3 and name HN )(resid 3 and name HA ) 1.8 0.0 1.5 assign (resid 3 and name HN )(resid 5 and name HB# ) 1.8 0.0 2.0 assign (resid 3 and name HN )(resid 2 and name HA ) 1.8 0.0 0.9 assign (resid 3 and name HN )(resid 3 and name HB# ) 1.8 0.0 1.4 assign (resid 4 and name HN )(resid 4 and name HA# ) 1.8 0.0 1.4 assign (resid 4 and name HN )(resid 5 and name HB# ) 1.8 0.0 2.0 assign (resid 4 and name HN )(resid 3 and name HA ) 1.8 0.0 1.5 assign (resid 4 and name HN )(resid 2 and name HA ) 1.8 0.0 3.2 assign (resid 4 and name HN )(resid 2 and name HB# ) 1.8 0.0 3.7 assign (resid 5 and name HN )(resid 4 and name HA# ) 1.8 0.0 2.0 assign (resid 5 and name HN )(resid 5 and name HB# ) 1.8 0.0 1.4 assign (resid 5 and name HN )(resid 5 and name HA ) 1.8 0.0 1.5 assign (resid 6 and name HN )(resid 6 and name HA ) 1.8 0.0 3.2 assign (resid 6 and name HN )(resid 6 and name HB# ) 1.8 0.0 2.0 assign (resid 6 and name HN )(resid 5 and name HA ) 1.8 0.0 1.5 assign (resid 6 and name HN )(resid 5 and name HB# ) 1.8 0.0 3.7 assign (resid 7 and name HN )(resid 7 and name HA# ) 1.8 0.0 2.0 assign (resid 7 and name HN )(resid 5 and name HB# ) 1.8 0.0 1.4 assign (resid 7 and name HN )(resid 5 and name HA ) 1.8 0.0 1.5 assign (resid 7 and name HN )(resid 6 and name HA ) 1.8 0.0 1.5 assign (resid 7 and name HN )(resid 6 and name HB# ) 1.8 0.0 2.0 assign (resid 7 and name HN )(resid 10 and name HB# ) 1.8 0.0 3.7 assign (resid 8 and name HN )(resid 22 and name HA ) 1.8 0.0 3.2 assign (resid 8 and name HN )(resid 7 and name HA# ) 1.8 0.0 2.0 assign (resid 8 and name HN )(resid 8 and name HB# ) 1.8 0.0 1.4 assign (resid 8 and name HN )(resid 8 and name HA ) 1.8 0.0 1.5 assign (resid 9 and name HN )(resid 8 and name HB# ) 1.8 0.0 2.0 assign (resid 9 and name HN )(resid 9 and name HB# ) 1.8 0.0 2.0 assign (resid 9 and name HN )(resid 9 and name HA ) 1.8 0.0 1.5 assign (resid 10 and name HN )(resid 10 and name HA ) 1.8 0.0 3.2 assign (resid 10 and name HN )(resid 10 and name HB# ) 1.8 0.0 2.0 assign (resid 10 and name HN )(resid 8 and name HB# ) 1.8 0.0 3.7 assign (resid 10 and name HN )(resid 9 and name HB# ) 1.8 0.0 3.7 assign (resid 11 and name HN )(resid 8 and name HB# ) 1.8 0.0 3.7 assign (resid 11 and name HN )(resid 10 and name HB# ) 1.8 0.0 3.7 assign (resid 11 and name HN )(resid 11 and name HA ) 1.8 0.0 1.5 assign (resid 11 and name HN )(resid 11 and name HB# ) 1.8 0.0 1.4 assign (resid 12 and name HN )(resid 12 and name HA ) 1.8 0.0 1.5 assign (resid 12 and name HN )(resid 12 and name HB# ) 1.8 0.0 2.0 assign (resid 12 and name HN )(resid 11 and name HA ) 1.8 0.0 0.9 assign (resid 13 and name HN )(resid 13 and name HB# ) 1.8 0.0 2.0 assign (resid 13 and name HN )(resid 13 and name HA ) 1.8 0.0 1.5 assign (resid 13 and name HN )(resid 12 and name HA ) 1.8 0.0 1.5 assign (resid 13 and name HN )(resid 11 and name HA ) 1.8 0.0 3.2 assign (resid 13 and name HN )(resid 17 and name HB# ) 1.8 0.0 1.4 assign (resid 13 and name HN )(resid 12 and name HB# ) 1.8 0.0 3.7 assign (resid 14 and name HN )(resid 13 and name HA ) 1.8 0.0 1.5 assign (resid 14 and name HN )(resid 14 and name HA# ) 1.8 0.0 1.4 assign (resid 14 and name HN )(resid 12 and name HA ) 1.8 0.0 3.2 assign (resid 14 and name HN )(resid 13 and name HB# ) 1.8 0.0 2.0 assign (resid 15 and name HN )(resid 14 and name HA# ) 1.8 0.0 2.0 assign (resid 15 and name HN )(resid 15 and name HA ) 1.8 0.0 1.5 assign (resid 15 and name HN )(resid 15 and name HB# ) 1.8 0.0 2.0 assign (resid 16 and name HN )(resid 16 and name HA# ) 1.8 0.0 2.0 assign (resid 16 and name HN )(resid 15 and name HA ) 1.8 0.0 1.5 assign (resid 16 and name HN )(resid 15 and name HB# ) 1.8 0.0 3.7 assign (resid 17 and name HN )(resid 13 and name HB# ) 1.8 0.0 3.7 assign (resid 17 and name HN )(resid 16 and name HA# ) 1.8 0.0 1.4 assign (resid 17 and name HN )(resid 17 and name HB# ) 1.8 0.0 1.4 assign (resid 17 and name HN )(resid 17 and name HA ) 1.8 0.0 0.9 assign (resid 18 and name HN )(resid 18 and name HA ) 1.8 0.0 1.5 assign (resid 18 and name HN )(resid 13 and name HB# ) 1.8 0.0 3.7 assign (resid 19 and name HN )(resid 18 and name HA ) 1.8 0.0 1.5 assign (resid 19 and name HN )(resid 18 and name HB# ) 1.8 0.0 2.0 assign (resid 19 and name HN )(resid 19 and name HB# ) 1.8 0.0 1.4 assign (resid 19 and name HN )(resid 22 and name HB# ) 1.8 0.0 3.7 assign (resid 20 and name HN )(resid 19 and name HA ) 1.8 0.0 1.5 ! above peak looks strong but might be overlapped with 19 to 19HA therefore reduced ! by one order (i.e. magnitude in question not assignment) assign (resid 20 and name HN )(resid 20 and name HB# ) 1.8 0.0 2.0 assign (resid 20 and name HN )(resid 20 and name HA ) 1.8 0.0 1.5 assign (resid 21 and name HN )(resid 21 and name HA ) 1.8 0.0 1.5 assign (resid 21 and name HN )(resid 21 and name HB# ) 1.8 0.0 2.0 assign (resid 21 and name HN )(resid 21 and name HD2# ) 1.8 0.0 3.7 assign (resid 21 and name HN )(resid 19 and name HB# ) 1.8 0.0 2.0 assign (resid 21 and name HN )(resid 20 and name HB# ) 1.8 0.0 2.0 assign (resid 21 and name HN )(resid 20 and name HA ) 1.8 0.0 3.2 assign (resid 22 and name HN )(resid 22 and name HA ) 1.8 0.0 3.2 assign (resid 22 and name HN )(resid 19 and name HB# ) 1.8 0.0 2.0 assign (resid 22 and name HN )(resid 22 and name HB# ) 1.8 0.0 2.0 assign (resid 22 and name HN )(resid 19 and name HB# ) 1.8 0.0 2.0 assign (resid 23 and name HN )(resid 20 and name HA ) 1.8 0.0 3.2 assign (resid 23 and name HN )(resid 23 and name HA# ) 1.8 0.0 1.4 assign (resid 23 and name HN )(resid 22 and name HA ) 1.8 0.0 3.2 assign (resid 23 and name HN )(resid 22 and name HB# ) 1.8 0.0 3.7 assign (resid 24 and name HN )(resid 24 and name HB# ) 1.8 0.0 2.0 assign (resid 24 and name HN )(resid 23 and name HA# ) 1.8 0.0 2.0 assign (resid 24 and name HN )(resid 20 and name HA ) 1.8 0.0 3.2 assign (resid 24 and name HN )(resid 24 and name HA ) 1.8 0.0 1.5 assign (resid 25 and name HN )(resid 25 and name HA ) 1.8 0.0 1.5 assign (resid 25 and name HN )(resid 24 and name HB# ) 1.8 0.0 3.7 assign (resid 25 and name HN )(resid 24 and name HA ) 1.8 0.0 0.9 assign (resid 25 and name HN )(resid 25 and name HB# ) 1.8 0.0 2.0 assign (resid 25 and name HN )(resid 25 and name HD# ) 1.8 0.0 2.0 ! sidechain(i)-sidechain(j) ! sidechains of asn assign (resid 21 and name HD2# )(resid 21 and name HB# ) 1.8 0.0 1.9 assign (resid 21 and name HD2# )(resid 21 and name HA ) 1.8 0.0 2.0 assign (resid 12 and name HD2# )(resid 12 and name HB# ) 1.8 0.0 2.5 assign (resid 21 and name HD2# )(reside 6 and name HB# ) 1.8 0.0 4.2 ! rest of side chains assign (resid 2 and name HA )(resid 2 and name HB# ) 1.8 0.0 3.7 assign (resid 3 and name HB# )(resid 3 and name HA ) 1.8 0.0 1.4 assign (resid 5 and name HA )(resid 5 and name HB# ) 1.8 0.0 2.0 assign (resid 5 and name HB# )(resid 11 and name HA ) 1.8 0.0 3.7 assign (resid 8 and name HB# )(resid 8 and name HA ) 1.8 0.0 1.4 assign (resid 8 and name HB# )(resid 7 and name HA# ) 1.8 0.0 4.2 assign (resid 8 and name HB# )(resid 9 and name HB# ) 1.8 0.0 4.2 assign (resid 8 and name HB# )(resid 9 and name HA ) 1.8 0.0 3.7 assign (resid 8 and name HB# )(resid 11 and name HB# ) 1.8 0.0 4.2 assign (resid 8 and name HB# )(resid 22 and name HB# ) 1.8 0.0 4.2 assign (resid 8 and name HB# )(resid 22 and name HA ) 1.8 0.0 3.7 assign (resid 9 and name HA )(resid 9 and name HB# ) 1.8 0.0 1.4 assign (resid 10 and name HA )(resid 10 and name HB# ) 1.8 0.0 2.0 assign (resid 11 and name HB# )(resid 8 and name HA ) 1.8 0.0 2.0 assign (resid 11 and name HB# )(resid 11 and name HA ) 1.8 0.0 3.7 assign (resid 12 and name HA )(resid 5 and name HB# ) 1.8 0.0 3.7 assign (resid 12 and name HD2# )(resid 12 and name HB# ) 1.8 0.0 1.4 assign (resid 12 and name HB# )(resid 12 and name HA ) 1.8 0.0 3.7 assign (resid 12 and name HA )(resid 4 and name HA# ) 1.8 0.0 3.7 assign (resid 12 and name HA )(resid 23 and name HA# ) 1.8 0.0 3.7 assign (resid 13 and name HB# )(resid 13 and name HA ) 1.8 0.0 3.7 assign (resid 13 and name HB# )(resid 17 and name HB# ) 1.8 0.0 2.5 assign (resid 17 and name HA )(resid 13 and name HB# ) 1.8 0.0 2.0 assign (resid 17 and name HA )(resid 17 and name HB# ) 1.8 0.0 1.4 assign (resid 18 and name HA )(resid 18 and name HB# ) 1.8 0.0 2.0 assign (resid 19 and name HB# )(resid 19 and name HA ) 1.8 0.0 2.0 assign (resid 19 and name HB# )(resid 22 and name HB# ) 1.8 0.0 4.2 assign (resid 21 and name HA )(resid 21 and name HB# ) 1.8 0.0 2.0 assign (resid 21 and name HB# )(resid 7 and name HA# ) 1.8 0.0 4.2 assign (resid 22 and name HA )(resid 22 and name HB# ) 1.8 0.0 2.0 assign (resid 23 and name HA# )(resid 14 and name HA# ) 1.8 0.0 2.5 assign (resid 25 and name HD# )(resid 25 and name HA ) 1.8 0.0 3.7 assign (resid 25 and name HB# )(resid 25 and name HA ) 1.8 0.0 1.4 set message=on echo=on end
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