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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512627 |
2lb9   |
15717 | cing | 1-original | 8 | XPLOR/CNS | distance | hydrogen bond | simple |
!! helix 1: assign ( resid 31 and name O ) ( resid 35 and name HN ) 1.9 0.4 0.6 assign ( resid 31 and name O ) ( resid 35 and name N ) 2.9 0.5 0.7 assign ( resid 32 and name O ) ( resid 36 and name HN ) 1.9 0.4 0.6 assign ( resid 32 and name O ) ( resid 36 and name N ) 2.9 0.5 0.7 assign ( resid 33 and name O ) ( resid 37 and name HN ) 1.9 0.4 0.6 assign ( resid 33 and name O ) ( resid 37 and name N ) 2.9 0.5 0.7 assign ( resid 34 and name O ) ( resid 38 and name HN ) 1.9 0.4 0.6 assign ( resid 34 and name O ) ( resid 38 and name N ) 2.9 0.5 0.7 assign ( resid 35 and name O ) ( resid 39 and name HN ) 1.9 0.4 0.6 assign ( resid 35 and name O ) ( resid 39 and name N ) 2.9 0.5 0.7 assign ( resid 36 and name O ) ( resid 40 and name HN ) 1.9 0.4 0.6 assign ( resid 36 and name O ) ( resid 40 and name N ) 2.9 0.5 0.7 assign ( resid 37 and name O ) ( resid 41 and name HN ) 1.9 0.4 0.6 assign ( resid 37 and name O ) ( resid 41 and name N ) 2.9 0.5 0.7 assign ( resid 38 and name O ) ( resid 42 and name HN ) 1.9 0.4 0.6 assign ( resid 38 and name O ) ( resid 42 and name N ) 2.9 0.5 0.7 assign ( resid 39 and name O ) ( resid 43 and name HN ) 1.9 0.4 0.6 assign ( resid 39 and name O ) ( resid 43 and name N ) 2.9 0.5 0.7 assign ( resid 40 and name O ) ( resid 44 and name HN ) 1.9 0.4 0.6 assign ( resid 40 and name O ) ( resid 44 and name N ) 2.9 0.5 0.7 assign ( resid 41 and name O ) ( resid 45 and name HN ) 1.9 0.4 0.6 assign ( resid 41 and name O ) ( resid 45 and name N ) 2.9 0.5 0.7 assign ( resid 42 and name O ) ( resid 46 and name HN ) 1.9 0.4 0.6 assign ( resid 42 and name O ) ( resid 46 and name N ) 2.9 0.5 0.7 ! added after run 26 assign ( resid 43 and name O ) ( resid 47 and name HN ) 1.9 0.4 0.6 assign ( resid 43 and name O ) ( resid 47 and name N ) 2.9 0.5 0.7 !! helix 2: !! X-ray: Pro 88:O...92:HN, no assignments for 88 and 89 !assign ( resid 88 and name O ) ( resid 92 and name HN ) 1.9 0.4 0.6 !assign ( resid 88 and name O ) ( resid 92 and name N ) 2.9 0.5 0.7 !assign ( resid 89 and name O ) ( resid 93 and name HN ) 1.9 0.4 0.6 !assign ( resid 89 and name O ) ( resid 93 and name N ) 2.9 0.5 0.7 assign ( resid 90 and name O ) ( resid 94 and name HN ) 1.9 0.4 0.6 assign ( resid 90 and name O ) ( resid 94 and name N ) 2.9 0.5 0.7 assign ( resid 91 and name O ) ( resid 95 and name HN ) 1.9 0.4 0.6 assign ( resid 91 and name O ) ( resid 95 and name N ) 2.9 0.5 0.7 !! X-ray: 93:O...96:HN, lowest_21 93:0...97:HN, OK in run 26 assign ( resid 92 and name O ) ( resid 96 and name HN ) 1.9 0.4 0.6 assign ( resid 92 and name O ) ( resid 96 and name N ) 2.9 0.5 0.7 assign ( resid 93 and name O ) ( resid 97 and name HN ) 1.9 0.4 0.6 assign ( resid 93 and name O ) ( resid 97 and name N ) 2.9 0.5 0.7 assign ( resid 94 and name O ) ( resid 98 and name HN ) 1.9 0.4 0.6 assign ( resid 94 and name O ) ( resid 98 and name N ) 2.9 0.5 0.7 !! helix 3: !! X-ray: 136:O...140:HN, but 136 has extended conformation assign ( resid 136 and name O ) ( resid 140 and name HN ) 1.9 0.4 0.6 assign ( resid 136 and name O ) ( resid 140 and name N ) 2.9 0.5 0.7 !! X-ray: Pro 137:O...141:HN assign ( resid 137 and name O ) ( resid 141 and name HN ) 1.9 0.4 0.6 assign ( resid 137 and name O ) ( resid 141 and name N ) 2.9 0.5 0.7 assign ( resid 138 and name O ) ( resid 142 and name HN ) 1.9 0.4 0.6 assign ( resid 138 and name O ) ( resid 142 and name N ) 2.9 0.5 0.7 assign ( resid 139 and name O ) ( resid 143 and name HN ) 1.9 0.4 0.6 assign ( resid 139 and name O ) ( resid 143 and name N ) 2.9 0.5 0.7 assign ( resid 140 and name O ) ( resid 144 and name HN ) 1.9 0.4 0.6 assign ( resid 140 and name O ) ( resid 144 and name N ) 2.9 0.5 0.7 assign ( resid 141 and name O ) ( resid 145 and name HN ) 1.9 0.4 0.6 assign ( resid 141 and name O ) ( resid 145 and name N ) 2.9 0.5 0.7 !! helix 4: !! X-ray and TALOS: assign ( resid 178 and name O ) ( resid 182 and name HN ) 1.9 0.4 0.6 assign ( resid 178 and name O ) ( resid 182 and name N ) 2.9 0.5 0.7 assign ( resid 179 and name O ) ( resid 183 and name HN ) 1.9 0.4 0.6 assign ( resid 179 and name O ) ( resid 183 and name N ) 2.9 0.5 0.7 assign ( resid 180 and name O ) ( resid 184 and name HN ) 1.9 0.4 0.6 assign ( resid 180 and name O ) ( resid 184 and name N ) 2.9 0.5 0.7 assign ( resid 181 and name O ) ( resid 185 and name HN ) 1.9 0.4 0.6 assign ( resid 181 and name O ) ( resid 185 and name N ) 2.9 0.5 0.7 assign ( resid 182 and name O ) ( resid 186 and name HN ) 1.9 0.4 0.6 assign ( resid 182 and name O ) ( resid 186 and name N ) 2.9 0.5 0.7 assign ( resid 183 and name O ) ( resid 187 and name HN ) 1.9 0.4 0.6 assign ( resid 183 and name O ) ( resid 187 and name N ) 2.9 0.5 0.7 assign ( resid 184 and name O ) ( resid 188 and name HN ) 1.9 0.4 0.6 assign ( resid 184 and name O ) ( resid 188 and name N ) 2.9 0.5 0.7 assign ( resid 185 and name O ) ( resid 189 and name HN ) 1.9 0.4 0.6 assign ( resid 185 and name O ) ( resid 189 and name N ) 2.9 0.5 0.7 assign ( resid 186 and name O ) ( resid 190 and name HN ) 1.9 0.4 0.6 assign ( resid 186 and name O ) ( resid 190 and name N ) 2.9 0.5 0.7 assign ( resid 187 and name O ) ( resid 191 and name HN ) 1.9 0.4 0.6 assign ( resid 187 and name O ) ( resid 191 and name N ) 2.9 0.5 0.7 assign ( resid 188 and name O ) ( resid 192 and name HN ) 1.9 0.4 0.6 assign ( resid 188 and name O ) ( resid 192 and name N ) 2.9 0.5 0.7 assign ( resid 189 and name O ) ( resid 193 and name HN ) 1.9 0.4 0.6 assign ( resid 189 and name O ) ( resid 193 and name N ) 2.9 0.5 0.7 assign ( resid 190 and name O ) ( resid 194 and name HN ) 1.9 0.4 0.6 assign ( resid 190 and name O ) ( resid 194 and name N ) 2.9 0.5 0.7 assign ( resid 191 and name O ) ( resid 195 and name HN ) 1.9 0.4 0.6 assign ( resid 191 and name O ) ( resid 195 and name N ) 2.9 0.5 0.7 assign ( resid 192 and name O ) ( resid 196 and name HN ) 1.9 0.4 0.6 assign ( resid 192 and name O ) ( resid 196 and name N ) 2.9 0.5 0.7 assign ( resid 193 and name O ) ( resid 197 and name HN ) 1.9 0.4 0.6 assign ( resid 193 and name O ) ( resid 197 and name N ) 2.9 0.5 0.7 assign ( resid 194 and name O ) ( resid 198 and name HN ) 1.9 0.4 0.6 assign ( resid 194 and name O ) ( resid 198 and name N ) 2.9 0.5 0.7 assign ( resid 195 and name O ) ( resid 199 and name HN ) 1.9 0.4 0.6 assign ( resid 195 and name O ) ( resid 199 and name N ) 2.9 0.5 0.7 assign ( resid 196 and name O ) ( resid 200 and name HN ) 1.9 0.4 0.6 assign ( resid 196 and name O ) ( resid 200 and name N ) 2.9 0.5 0.7 !! antiparallel beta sheet: !reciprocal H-bond also missing in X-ray assign ( resid 49 and name O ) ( resid 70 and name HN ) 1.9 0.4 0.6 assign ( resid 49 and name O ) ( resid 70 and name N ) 2.9 0.5 0.7 assign ( resid 50 and name O ) ( resid 169 and name HN ) 1.9 0.4 0.6 assign ( resid 50 and name O ) ( resid 169 and name N ) 2.9 0.5 0.7 assign ( resid 169 and name O ) ( resid 50 and name HN ) 1.9 0.4 0.6 assign ( resid 169 and name O ) ( resid 50 and name N ) 2.9 0.5 0.7 assign ( resid 51 and name O ) ( resid 68 and name HN ) 1.9 0.4 0.6 assign ( resid 51 and name O ) ( resid 68 and name N ) 2.9 0.5 0.7 assign ( resid 68 and name O ) ( resid 51 and name HN ) 1.9 0.4 0.6 assign ( resid 68 and name O ) ( resid 51 and name N ) 2.9 0.5 0.7 assign ( resid 52 and name O ) ( resid 167 and name HN ) 1.9 0.4 0.6 assign ( resid 52 and name O ) ( resid 167 and name N ) 2.9 0.5 0.7 assign ( resid 167 and name O ) ( resid 52 and name HN ) 1.9 0.4 0.6 assign ( resid 167 and name O ) ( resid 52 and name N ) 2.9 0.5 0.7 !reciprocal H-bond also missing in X-ray assign ( resid 66 and name O ) ( resid 53 and name HN ) 1.9 0.4 0.6 assign ( resid 66 and name O ) ( resid 53 and name N ) 2.9 0.5 0.7 assign ( resid 54 and name O ) ( resid 165 and name HN ) 1.9 0.4 0.6 assign ( resid 54 and name O ) ( resid 165 and name N ) 2.9 0.5 0.7 assign ( resid 165 and name O ) ( resid 54 and name HN ) 1.9 0.4 0.6 assign ( resid 165 and name O ) ( resid 54 and name N ) 2.9 0.5 0.7 ! not obvious in NMR 0-26, may reduce beta twist, leave a pair out: assign ( resid 55 and name O ) ( resid 63 and name HN ) 1.9 0.4 0.6 assign ( resid 55 and name O ) ( resid 63 and name N ) 2.9 0.5 0.7 assign ( resid 63 and name O ) ( resid 55 and name HN ) 1.9 0.4 0.6 assign ( resid 63 and name O ) ( resid 55 and name N ) 2.9 0.5 0.7 !reciprocal H-bond also missing in X-ray assign ( resid 163 and name O ) ( resid 56 and name HN ) 1.9 0.4 0.6 assign ( resid 163 and name O ) ( resid 56 and name N ) 2.9 0.5 0.7 assign ( resid 57 and name O ) ( resid 60 and name HN ) 1.9 0.4 0.6 assign ( resid 57 and name O ) ( resid 60 and name N ) 2.9 0.5 0.7 !reciprocal H-bond also missing in X-ray assign ( resid 61 and name O ) ( resid 57 and name HN ) 1.9 0.4 0.6 assign ( resid 61 and name O ) ( resid 57 and name N ) 2.9 0.5 0.7 ! 1st pair is 2.27A in X-ray, 2nd pair seen in NMR assign ( resid 82 and name O ) ( resid 62 and name HN ) 1.9 0.4 0.6 assign ( resid 82 and name O ) ( resid 62 and name N ) 2.9 0.5 0.7 assign ( resid 62 and name O ) ( resid 82 and name HN ) 1.9 0.4 0.6 assign ( resid 62 and name O ) ( resid 82 and name N ) 2.9 0.5 0.7 !reciprocal H-bond also missing in X-ray assign ( resid 64 and name O ) ( resid 79 and name HN ) 1.9 0.4 0.6 assign ( resid 64 and name O ) ( resid 79 and name N ) 2.9 0.5 0.7 !reciprocal H-bond also missing in X-ray, 2.2A in NMR and X-ray assign ( resid 80 and name O ) ( resid 64 and name HN ) 1.9 0.4 0.6 assign ( resid 80 and name O ) ( resid 64 and name N ) 2.9 0.5 0.7 !reciprocal H-bond also missing in X-ray assign ( resid 53 and name O ) ( resid 65 and name HN ) 1.9 0.4 0.6 assign ( resid 53 and name O ) ( resid 65 and name N ) 2.9 0.5 0.7 !kink also in X-ray assign ( resid 77 and name O ) ( resid 80 and name HN ) 1.9 0.4 0.6 assign ( resid 77 and name O ) ( resid 80 and name N ) 2.9 0.5 0.7 !3-10 helix (1.8A in run 373): assign ( resid 83 and name O ) ( resid 86 and name HN ) 1.9 0.4 0.6 assign ( resid 83 and name O ) ( resid 86 and name N ) 2.9 0.5 0.7 assign ( resid 149 and name O ) ( resid 106 and name HN ) 1.9 0.4 0.6 assign ( resid 149 and name O ) ( resid 106 and name N ) 2.9 0.5 0.7 assign ( resid 150 and name O ) ( resid 170 and name HN ) 1.9 0.4 0.6 assign ( resid 150 and name O ) ( resid 170 and name N ) 2.9 0.5 0.7 assign ( resid 170 and name O ) ( resid 150 and name HN ) 1.9 0.4 0.6 assign ( resid 170 and name O ) ( resid 150 and name N ) 2.9 0.5 0.7 assign ( resid 151 and name O ) ( resid 103 and name HN ) 1.9 0.4 0.6 assign ( resid 151 and name O ) ( resid 103 and name N ) 2.9 0.5 0.7 assign ( resid 103 and name O ) ( resid 151 and name HN ) 1.9 0.4 0.6 assign ( resid 103 and name O ) ( resid 151 and name N ) 2.9 0.5 0.7 assign ( resid 152 and name O ) ( resid 168 and name HN ) 1.9 0.4 0.6 assign ( resid 152 and name O ) ( resid 168 and name N ) 2.9 0.5 0.7 assign ( resid 168 and name O ) ( resid 152 and name HN ) 1.9 0.4 0.6 assign ( resid 168 and name O ) ( resid 152 and name N ) 2.9 0.5 0.7 !assign ( resid 153 and name O ) ( resid 101 and name HN ) 1.9 0.4 0.6 !assign ( resid 153 and name O ) ( resid 101 and name N ) 2.9 0.5 0.7 assign ( resid 101 and name O ) ( resid 153 and name HN ) 1.9 0.4 0.6 assign ( resid 101 and name O ) ( resid 153 and name N ) 2.9 0.5 0.7 assign ( resid 154 and name O ) ( resid 166 and name HN ) 1.9 0.4 0.6 assign ( resid 154 and name O ) ( resid 166 and name N ) 2.9 0.5 0.7 assign ( resid 166 and name O ) ( resid 154 and name HN ) 1.9 0.4 0.6 assign ( resid 166 and name O ) ( resid 154 and name N ) 2.9 0.5 0.7 assign ( resid 156 and name O ) ( resid 164 and name HN ) 1.9 0.4 0.6 assign ( resid 156 and name O ) ( resid 164 and name N ) 2.9 0.5 0.7 assign ( resid 164 and name O ) ( resid 156 and name HN ) 1.9 0.4 0.6 assign ( resid 164 and name O ) ( resid 156 and name N ) 2.9 0.5 0.7 !tight beta turn, (irregular pairing) assign ( resid 158 and name O ) ( resid 161 and name HN ) 1.9 0.4 0.6 assign ( resid 158 and name O ) ( resid 161 and name N ) 2.9 0.5 0.7 assign ( resid 161 and name O ) ( resid 158 and name HN ) 1.9 0.4 0.6 assign ( resid 161 and name O ) ( resid 158 and name N ) 2.9 0.5 0.7
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