NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
500069 |
2kqa   |
cing | 3-converted-DOCR | XPLOR/CNS | distance | hydrogen bond | ambi |
assi
(( segid " A" and resid 3 and name HN ))
(( segid " A" and resid 102 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 3 and name N ))
(( segid " A" and resid 102 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 4 and name HN ))
(( segid " A" and resid 83 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 4 and name N ))
(( segid " A" and resid 83 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 5 and name HH ))
(( segid " A" and resid 97 and name O ))
2.500 0.500 0.230
assi
(( segid " A" and resid 5 and name OH ))
(( segid " A" and resid 97 and name O ))
3.500 0.500 0.230
assi
(( segid " A" and resid 6 and name HN ))
(( segid " A" and resid 85 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 6 and name N ))
(( segid " A" and resid 85 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 9 and name HH ))
(( segid " A" and resid 77 and name OD2 ))
2.500 0.500 0.230
or
(( segid " A" and resid 9 and name HH ))
(( segid " A" and resid 77 and name OD1 ))
assi
(( segid " A" and resid 9 and name OH ))
(( segid " A" and resid 77 and name OD2 ))
3.500 0.500 0.230
or
(( segid " A" and resid 9 and name OH ))
(( segid " A" and resid 77 and name OD1 ))
assi
(( segid " A" and resid 13 and name HN ))
(( segid " A" and resid 10 and name O ))
2.500 0.500 0.230
assi
(( segid " A" and resid 13 and name N ))
(( segid " A" and resid 10 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 17 and name HN ))
(( segid " A" and resid 14 and name O ))
2.500 0.500 0.230
assi
(( segid " A" and resid 17 and name N ))
(( segid " A" and resid 14 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 18 and name HN ))
(( segid " A" and resid 15 and name O ))
2.500 0.500 0.230
assi
(( segid " A" and resid 18 and name N ))
(( segid " A" and resid 15 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 20 and name HN ))
(( segid " A" and resid 76 and name O ))
2.500 0.500 0.230
assi
(( segid " A" and resid 20 and name N ))
(( segid " A" and resid 76 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 21 and name HN ))
(( segid " A" and resid 19 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 21 and name N ))
(( segid " A" and resid 19 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 21 and name HG ))
(( segid " A" and resid 18 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 21 and name OG ))
(( segid " A" and resid 18 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 21 and name HN ))
(( segid " A" and resid 52 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 21 and name N ))
(( segid " A" and resid 52 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 24 and name HN ))
(( segid " A" and resid 53 and name OD2 ))
2.500 0.500 0.200
or
(( segid " A" and resid 24 and name HN ))
(( segid " A" and resid 53 and name OD1 ))
assi
(( segid " A" and resid 24 and name N ))
(( segid " A" and resid 53 and name OD2 ))
3.500 0.500 0.200
or
(( segid " A" and resid 24 and name N ))
(( segid " A" and resid 53 and name OD1 ))
assi
(( segid " A" and resid 31 and name HN ))
(( segid " A" and resid 27 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 31 and name N ))
(( segid " A" and resid 27 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 45 and name HN ))
(( segid " A" and resid 84 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 45 and name N ))
(( segid " A" and resid 84 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 46 and name HN ))
(( segid " A" and resid 77 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 46 and name N ))
(( segid " A" and resid 77 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 49 and name HN ))
(( segid " A" and resid 46 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 49 and name N ))
(( segid " A" and resid 46 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 57 and name HN ))
(( segid " A" and resid 54 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 57 and name N ))
(( segid " A" and resid 54 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 58 and name HN ))
(( segid " A" and resid 75 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 58 and name N ))
(( segid " A" and resid 75 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 59 and name HG1 ))
(( segid " A" and resid 56 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 59 and name OG1 ))
(( segid " A" and resid 56 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 61 and name HN ))
(( segid " A" and resid 73 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 61 and name N ))
(( segid " A" and resid 73 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 62 and name HN ))
(( segid " A" and resid 108 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 62 and name N ))
(( segid " A" and resid 108 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 63 and name HN ))
(( segid " A" and resid 71 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 63 and name N ))
(( segid " A" and resid 71 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 64 and name HN ))
(( segid " A" and resid 106 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 64 and name N ))
(( segid " A" and resid 106 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 65 and name HN ))
(( segid " A" and resid 69 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 65 and name N ))
(( segid " A" and resid 69 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 68 and name HN ))
(( segid " A" and resid 65 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 68 and name N ))
(( segid " A" and resid 65 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 69 and name HD21))
(( segid " A" and resid 93 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 69 and name ND2 ))
(( segid " A" and resid 93 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 71 and name HN ))
(( segid " A" and resid 63 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 71 and name N ))
(( segid " A" and resid 63 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 73 and name HN ))
(( segid " A" and resid 61 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 73 and name N ))
(( segid " A" and resid 61 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 74 and name HN ))
(( segid " A" and resid 42 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 74 and name N ))
(( segid " A" and resid 42 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 75 and name HN ))
(( segid " A" and resid 59 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 75 and name N ))
(( segid " A" and resid 59 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 79 and name HN ))
(( segid " A" and resid 46 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 79 and name N ))
(( segid " A" and resid 46 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 83 and name HN ))
(( segid " A" and resid 2 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 83 and name N ))
(( segid " A" and resid 2 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 84 and name HN ))
(( segid " A" and resid 45 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 84 and name N ))
(( segid " A" and resid 45 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 84 and name HD22))
(( segid " A" and resid 6 and name OD2 ))
2.500 0.500 0.230
or
(( segid " A" and resid 84 and name HD22))
(( segid " A" and resid 6 and name OD1 ))
assi
(( segid " A" and resid 84 and name ND2 ))
(( segid " A" and resid 6 and name OD2 ))
3.500 0.500 0.200
or
(( segid " A" and resid 84 and name ND2 ))
(( segid " A" and resid 6 and name OD1 ))
assi
(( segid " A" and resid 85 and name HN ))
(( segid " A" and resid 4 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 85 and name N ))
(( segid " A" and resid 4 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 86 and name HN ))
(( segid " A" and resid 43 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 86 and name N ))
(( segid " A" and resid 43 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 86 and name HD22))
(( segid " A" and resid 9 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 86 and name ND2 ))
(( segid " A" and resid 9 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 90 and name HN ))
(( segid " A" and resid 86 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 90 and name N ))
(( segid " A" and resid 86 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 91 and name HN ))
(( segid " A" and resid 87 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 91 and name N ))
(( segid " A" and resid 87 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 91 and name HG1 ))
(( segid " A" and resid 87 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 91 and name OG1 ))
(( segid " A" and resid 87 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 92 and name HN ))
(( segid " A" and resid 88 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 92 and name N ))
(( segid " A" and resid 88 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 93 and name HN ))
(( segid " A" and resid 89 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 93 and name N ))
(( segid " A" and resid 89 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 94 and name HN ))
(( segid " A" and resid 90 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 94 and name N ))
(( segid " A" and resid 90 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 95 and name HN ))
(( segid " A" and resid 91 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 95 and name N ))
(( segid " A" and resid 91 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 101 and name HN ))
(( segid " A" and resid 99 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 101 and name N ))
(( segid " A" and resid 99 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 102 and name HN ))
(( segid " A" and resid 3 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 102 and name N ))
(( segid " A" and resid 3 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 104 and name HN ))
(( segid " A" and resid 1 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 104 and name N ))
(( segid " A" and resid 1 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 105 and name HN ))
(( segid " A" and resid 1 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 105 and name N ))
(( segid " A" and resid 1 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 106 and name HN ))
(( segid " A" and resid 64 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 106 and name N ))
(( segid " A" and resid 64 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 108 and name HN ))
(( segid " A" and resid 62 and name O ))
2.040 0.230 0.230
assi
(( segid " A" and resid 108 and name N ))
(( segid " A" and resid 62 and name O ))
3.000 0.200 0.200
assi
(( segid " A" and resid 114 and name HN ))
(( segid " A" and resid 111 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 114 and name N ))
(( segid " A" and resid 111 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 115 and name HN ))
(( segid " A" and resid 112 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 115 and name N ))
(( segid " A" and resid 112 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 116 and name HN ))
(( segid " A" and resid 112 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 116 and name N ))
(( segid " A" and resid 112 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 117 and name HN ))
(( segid " A" and resid 113 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 117 and name N ))
(( segid " A" and resid 113 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 118 and name HN ))
(( segid " A" and resid 114 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 118 and name N ))
(( segid " A" and resid 114 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 119 and name HN ))
(( segid " A" and resid 115 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 119 and name N ))
(( segid " A" and resid 115 and name O ))
3.500 0.500 0.200
assi
(( segid " A" and resid 120 and name HN ))
(( segid " A" and resid 116 and name O ))
2.500 0.500 0.200
assi
(( segid " A" and resid 120 and name N ))
(( segid " A" and resid 116 and name O ))
3.500 0.500 0.200
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