NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
10563 | 1pyj | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H5* C 1 2H5* C 1 6.386 15.258 -9.494 2 2H5* C 1 1H5* C 1 6.931 16.741 -9.083 3 H4* C 1 H4* C 1 7.473 15.889 -6.907 4 H3* C 1 H3* C 1 7.446 13.491 -7.632 5 H1* C 1 H1* C 1 4.366 14.761 -5.882 6 1H4 C 1 1H4 C 1 -0.106 15.541 -10.661 7 2H4 C 1 2H4 C 1 -0.910 15.800 -9.148 8 H5 C 1 HC5 C 1 2.295 15.038 -10.729 9 H6 C 1 HC6 C 1 4.250 14.710 -9.437 10 H5T C 1 HO5 C 1 8.474 15.590 -10.244 11 2H2* C 1 1H2* C 1 5.125 12.756 -6.704 12 1H2* C 1 2H2* C 1 5.171 13.302 -8.242 13 1H5* C 2 2H5* C 2 5.292 14.540 -3.774 14 2H5* C 2 1H5* C 2 6.325 13.911 -2.677 15 H4* C 2 H4* C 2 4.453 14.010 -1.451 16 H3* C 2 H3* C 2 5.072 11.576 -1.791 17 H1* C 2 H1* C 2 1.543 12.621 -2.421 18 1H4 C 2 1H4 C 2 0.753 12.365 -8.962 19 2H4 C 2 2H4 C 2 -0.800 12.679 -8.261 20 H5 C 2 HC5 C 2 2.743 12.150 -7.541 21 H6 C 2 HC6 C 2 3.561 12.194 -5.321 22 2H2* C 2 1H2* C 2 2.714 10.636 -2.355 23 1H2* C 2 2H2* C 2 3.676 11.059 -3.604 24 1H5* A 3 2H5* A 3 0.896 12.594 -0.101 25 2H5* A 3 1H5* A 3 0.964 11.949 1.397 26 H4* A 3 H4* A 3 -1.260 11.967 0.970 27 H3* A 3 H3* A 3 -0.359 9.571 1.283 28 H1* A 3 H1* A 3 -2.767 10.395 -1.427 29 H8 A 3 HC8 A 3 0.684 9.907 -2.859 30 1H6 A 3 1H6 A 3 -2.009 9.791 -8.356 31 2H6 A 3 2H6 A 3 -0.499 9.671 -7.515 32 H2 A 3 HC2 A 3 -5.095 10.442 -5.183 33 2H2* A 3 1H2* A 3 -1.910 8.458 -0.495 34 1H2* A 3 2H2* A 3 -0.377 8.831 -0.917 35 1H5* T 4 2H5* T 4 -4.702 10.380 0.204 36 2H5* T 4 1H5* T 4 -5.550 9.831 1.487 37 H4* T 4 H4* T 4 -7.068 9.794 -0.208 38 H3* T 4 H3* T 4 -6.613 7.451 0.805 39 1H2* T 4 2H2* T 4 -5.426 6.476 -0.927 40 2H2* T 4 1H2* T 4 -6.942 6.168 -1.448 41 H1* T 4 H1* T 4 -6.961 8.004 -2.857 42 H3 T 4 HN3 T 4 -4.255 7.246 -6.351 43 1H5M T 4 1H5A T 4 -0.823 6.162 -3.538 44 2H5M T 4 2H5A T 4 -0.842 7.588 -2.750 45 3H5M T 4 3H5A T 4 -1.436 6.252 -2.031 46 H6 T 4 HC6 T 4 -3.652 7.357 -1.722 47 1H5* A 5 2H5* A 5 -9.667 7.955 -2.595 48 2H5* A 5 1H5* A 5 -11.086 7.354 -2.056 49 H4* A 5 H4* A 5 -11.178 7.052 -4.317 50 H3* A 5 H3* A 5 -11.308 4.836 -2.947 51 H1* A 5 H1* A 5 -9.372 5.177 -6.109 52 H8 A 5 HC8 A 5 -7.037 5.008 -3.156 53 1H6 A 5 1H6 A 5 -2.592 3.852 -7.204 54 2H6 A 5 2H6 A 5 -2.958 4.064 -5.524 55 H2 A 5 HC2 A 5 -6.483 4.365 -9.350 56 2H2* A 5 1H2* A 5 -10.150 3.419 -4.823 57 1H2* A 5 2H2* A 5 -9.287 3.881 -3.516 58 1H5* T 6 2H5* T 6 -11.995 4.826 -7.525 59 2H5* T 6 1H5* T 6 -13.447 4.119 -7.771 60 H4* T 6 H4* T 6 -12.245 3.713 -9.687 61 H3* T 6 H3* T 6 -13.058 1.569 -8.395 62 1H2* T 6 2H2* T 6 -11.031 0.655 -7.815 63 2H2* T 6 1H2* T 6 -11.064 0.147 -9.366 64 H1* T 6 H1* T 6 -9.750 1.901 -10.097 65 H3 T 6 HN3 T 6 -5.562 1.245 -8.646 66 1H5M T 6 1H5A T 6 -7.183 0.803 -4.335 67 2H5M T 6 2H5A T 6 -7.498 2.401 -4.328 68 3H5M T 6 3H5A T 6 -8.724 1.330 -4.396 69 H6 T 6 HC6 T 6 -9.684 1.850 -6.538 70 1H5* G 7 2H5* +G 7 -11.121 1.276 -12.219 71 2H5* G 7 1H5* +G 7 -11.842 0.473 -13.444 72 H4* G 7 H4* +G 7 -9.522 0.229 -13.662 73 H3* G 7 H3* +G 7 -11.041 -1.962 -13.615 74 H1* G 7 H1* +G 7 -7.612 -1.557 -12.149 75 H8 G 7 HC8 +G 7 -10.342 -2.141 -9.570 76 1H2 G 7 1H2 +G 7 -2.911 -2.327 -9.055 77 2H2 G 7 2H2 +G 7 -3.505 -1.870 -10.705 78 2H2* G 7 1H2* +G 7 -8.870 -3.332 -12.912 79 1H2* G 7 2H2* +G 7 -10.075 -3.048 -11.847 80 1H5* G 8 2H5* G 8 -6.648 -2.041 -15.015 81 2H5* G 8 1H5* G 8 -6.817 -2.434 -16.591 82 H4* G 8 H4* G 8 -4.725 -3.156 -16.181 83 H3* G 8 H3* G 8 -6.228 -5.127 -16.761 84 H1* G 8 H1* G 8 -3.956 -5.372 -13.816 85 H8 G 8 HC8 G 8 -7.514 -5.100 -12.766 86 H1 G 8 HN1 G 8 -3.268 -5.495 -8.035 87 1H2 G 8 1H2 G 8 -0.956 -5.362 -10.552 88 2H2 G 8 2H2 G 8 -1.262 -5.472 -8.850 89 2H2* G 8 1H2* G 8 -5.355 -6.801 -14.973 90 1H2* G 8 2H2* G 8 -6.688 -5.931 -14.612 91 1H5* C 9 2H5* C 9 -1.733 -5.920 -16.068 92 2H5* C 9 1H5* C 9 -1.090 -7.029 -17.080 93 H4* C 9 H4* C 9 0.012 -7.204 -15.030 94 H3* C 9 H3* C 9 -1.116 -9.393 -16.038 95 H1* C 9 H1* C 9 -0.917 -8.437 -12.419 96 1H4 C 9 1H4 C 9 -7.225 -8.270 -10.514 97 2H4 C 9 2H4 C 9 -6.247 -8.302 -9.085 98 H5 C 9 HC5 C 9 -6.187 -8.300 -12.738 99 H6 C 9 HC6 C 9 -4.143 -8.363 -13.929 100 2H2* C 9 1H2* C 9 -1.154 -10.414 -13.585 101 1H2* C 9 2H2* C 9 -2.528 -9.919 -14.314 102 1H5* C 10 2H5* C 10 1.948 -9.858 -12.646 103 2H5* C 10 1H5* C 10 2.899 -11.178 -12.777 104 H4* C 10 H4* C 10 2.242 -10.929 -10.534 105 H3* C 10 H3* C 10 1.419 -13.253 -11.844 106 H1* C 10 H1* C 10 0.058 -11.093 -8.947 107 1H4 C 10 1H4 C 10 -6.254 -11.388 -10.776 108 2H4 C 10 2H4 C 10 -6.233 -11.322 -9.044 109 H5 C 10 HC5 C 10 -4.156 -11.491 -12.046 110 H6 C 10 HC6 C 10 -1.795 -11.545 -11.899 111 2H2* C 10 1H2* C 10 0.624 -13.271 -9.135 112 1H2* C 10 2H2* C 10 -0.379 -13.497 -10.402 113 1H5* C 11 2H5* C 11 2.571 -13.087 -7.703 114 2H5* C 11 1H5* C 11 3.627 -14.227 -7.201 115 H4* C 11 H4* C 11 2.199 -13.847 -5.425 116 H3* C 11 H3* C 11 2.342 -16.323 -6.290 117 H1* C 11 H1* C 11 -0.799 -14.661 -5.152 118 1H4 C 11 1H4 C 11 -4.712 -14.662 -10.456 119 2H4 C 11 2H4 C 11 -5.715 -14.408 -9.067 120 H5 C 11 HC5 C 11 -2.289 -14.965 -10.209 121 H6 C 11 HC6 C 11 -0.490 -15.074 -8.675 122 H3T C 11 HO3 C 11 1.883 -16.843 -4.214 123 2H2* C 11 1H2* C 11 -0.102 -16.843 -5.463 124 1H2* C 11 2H2* C 11 0.192 -16.613 -7.052 125 1H5* G 12 2H5* G 12 -14.021 -16.085 -3.513 126 2H5* G 12 1H5* G 12 -14.873 -14.893 -2.793 127 H4* G 12 H4* G 12 -12.878 -15.217 -1.602 128 H3* G 12 H3* G 12 -13.562 -12.819 -2.141 129 H1* G 12 H1* G 12 -10.058 -13.917 -2.769 130 H8 G 12 HC8 G 12 -11.999 -13.883 -5.969 131 H1 G 12 HN1 G 12 -5.671 -14.350 -6.531 132 1H2 G 12 1H2 G 12 -5.700 -14.279 -3.112 133 2H2 G 12 2H2 G 12 -4.763 -14.375 -4.565 134 H5T G 12 HO5 G 12 -14.859 -14.660 -5.029 135 2H2* G 12 1H2* G 12 -11.215 -11.918 -2.815 136 1H2* G 12 2H2* G 12 -12.211 -12.422 -4.008 137 1H5* G 13 2H5* G 13 -9.519 -13.494 0.343 138 2H5* G 13 1H5* G 13 -9.662 -12.430 1.573 139 H4* G 13 H4* G 13 -7.387 -12.731 1.148 140 H3* G 13 H3* G 13 -8.250 -10.308 1.307 141 H1* G 13 H1* G 13 -5.885 -11.342 -1.370 142 H8 G 13 HC8 G 13 -9.347 -11.011 -2.755 143 H1 G 13 HN1 G 13 -4.634 -11.340 -7.027 144 1H2 G 13 1H2 G 13 -2.614 -11.594 -4.280 145 2H2 G 13 2H2 G 13 -2.734 -11.541 -6.006 146 2H2* G 13 1H2* G 13 -6.714 -9.338 -0.563 147 1H2* G 13 2H2* G 13 -8.255 -9.722 -0.941 148 1H5* G 14 2H5* G 14 -3.842 -10.978 0.095 149 2H5* G 14 1H5* G 14 -3.081 -10.427 1.431 150 H4* G 14 H4* G 14 -1.486 -10.116 -0.118 151 H3* G 14 H3* G 14 -2.318 -7.842 0.754 152 H1* G 14 H1* G 14 -1.747 -8.416 -2.875 153 H8 G 14 HC8 G 14 -5.403 -8.296 -2.101 154 H1 G 14 HN1 G 14 -3.850 -8.360 -8.279 155 1H2 G 14 1H2 G 14 -0.638 -8.581 -7.124 156 2H2 G 14 2H2 G 14 -1.699 -8.501 -8.490 157 2H2* G 14 1H2* G 14 -2.167 -6.585 -1.524 158 1H2* G 14 2H2* G 14 -3.619 -7.160 -1.048 159 1H5* C 15 2H5* C 15 1.564 -8.027 -1.927 160 2H5* C 15 1H5* C 15 2.655 -6.981 -1.308 161 H4* C 15 H4* C 15 3.019 -7.149 -3.614 162 H3* C 15 H3* C 15 2.905 -4.793 -2.583 163 H1* C 15 H1* C 15 1.147 -5.582 -5.764 164 1H4 C 15 1H4 C 15 -5.291 -5.179 -4.403 165 2H4 C 15 2H4 C 15 -5.127 -5.293 -6.124 166 H5 C 15 HC5 C 15 -3.310 -5.213 -2.955 167 H6 C 15 HC6 C 15 -0.948 -5.355 -2.892 168 2H2* C 15 1H2* C 15 1.649 -3.665 -4.569 169 1H2* C 15 2H2* C 15 0.781 -4.143 -3.270 170 1H5* C 16 2H5* C 16 4.672 -5.241 -6.980 171 2H5* C 16 1H5* C 16 5.951 -4.231 -7.080 172 H4* C 16 H4* C 16 5.019 -4.404 -9.210 173 H3* C 16 H3* C 16 5.466 -2.034 -8.317 174 H1* C 16 H1* C 16 2.275 -2.858 -10.036 175 1H4 C 16 1H4 C 16 -2.415 -2.436 -5.423 176 2H4 C 16 2H4 C 16 -3.204 -2.537 -6.962 177 H5 C 16 HC5 C 16 0.034 -2.485 -5.268 178 H6 C 16 HC6 C 16 2.056 -2.631 -6.488 179 2H2* C 16 1H2* C 16 3.334 -0.928 -9.324 180 1H2* C 16 2H2* C 16 3.304 -1.388 -7.758 181 1H5* A 17 2H5* A 17 3.219 -2.488 -12.270 182 2H5* A 17 1H5* A 17 4.143 -1.762 -13.404 183 H4* A 17 H4* A 17 2.023 -1.550 -14.212 184 H3* A 17 H3* A 17 3.196 0.735 -13.733 185 H1* A 17 H1* A 17 -0.394 0.068 -12.991 186 H8 A 17 HC8 A 17 1.586 0.009 -9.787 187 1H6 A 17 1H6 A 17 -3.731 0.959 -6.908 188 2H6 A 17 2H6 A 17 -2.031 0.708 -6.695 189 H2 A 17 HC2 A 17 -4.413 0.861 -11.327 190 2H2* A 17 1H2* A 17 0.935 1.950 -13.187 191 1H2* A 17 2H2* A 17 1.918 1.489 -11.967 192 1H5* T 18 2H5* T 18 -0.991 0.743 -15.658 193 2H5* T 18 1H5* T 18 -0.872 1.573 -17.059 194 H4* T 18 H4* T 18 -3.023 1.922 -16.327 195 H3* T 18 H3* T 18 -1.562 4.095 -16.620 196 1H2* T 18 2H2* T 18 -1.510 4.840 -14.448 197 2H2* T 18 1H2* T 18 -3.008 5.373 -14.822 198 H1* T 18 H1* T 18 -4.031 3.532 -13.873 199 H3 T 18 HN3 T 18 -3.654 3.913 -9.424 200 1H5M T 18 1H5A T 18 1.248 3.790 -11.432 201 2H5M T 18 2H5A T 18 0.940 4.238 -9.896 202 3H5M T 18 3H5A T 18 0.969 2.658 -10.294 203 H6 T 18 HC6 T 18 -0.601 3.442 -12.925 204 1H5* A 19 2H5* A 19 -6.189 4.448 -15.676 205 2H5* A 19 1H5* A 19 -6.730 5.414 -16.876 206 H4* A 19 H4* A 19 -8.087 5.853 -15.068 207 H3* A 19 H3* A 19 -6.869 7.914 -16.068 208 H1* A 19 H1* A 19 -7.212 7.386 -12.402 209 H8 A 19 HC8 A 19 -3.662 6.742 -13.495 210 1H6 A 19 1H6 A 19 -2.201 6.842 -7.551 211 2H6 A 19 2H6 A 19 -1.583 6.662 -9.159 212 H2 A 19 HC2 A 19 -6.603 7.478 -8.026 213 2H2* A 19 1H2* A 19 -6.605 9.144 -13.777 214 1H2* A 19 2H2* A 19 -5.327 8.335 -14.393 215 1H5* T 20 2H5* T 20 -9.901 8.285 -12.593 216 2H5* T 20 1H5* T 20 -11.000 9.397 -13.067 217 H4* T 20 H4* T 20 -10.995 9.422 -10.752 218 H3* T 20 H3* T 20 -10.574 11.707 -11.941 219 1H2* T 20 2H2* T 20 -8.364 12.061 -11.381 220 2H2* T 20 1H2* T 20 -9.053 12.615 -10.009 221 H1* T 20 H1* T 20 -8.732 10.614 -8.894 222 H3 T 20 HN3 T 20 -4.363 10.209 -7.982 223 1H5M T 20 1H5A T 20 -4.831 10.764 -13.221 224 2H5M T 20 2H5A T 20 -3.396 10.816 -12.451 225 3H5M T 20 3H5A T 20 -4.085 9.379 -12.796 226 H6 T 20 HC6 T 20 -6.856 10.521 -11.917 227 1H5* G 21 2H5* G 21 -10.625 11.385 -7.344 228 2H5* G 21 1H5* G 21 -11.916 12.298 -6.935 229 H4* G 21 H4* G 21 -10.612 12.399 -5.080 230 H3* G 21 H3* G 21 -10.980 14.715 -6.146 231 H1* G 21 H1* G 21 -7.634 13.667 -4.912 232 H8 G 21 HC8 G 21 -7.752 13.544 -8.649 233 H1 G 21 HN1 G 21 -1.974 13.080 -6.010 234 1H2 G 21 1H2 G 21 -3.677 13.297 -3.052 235 2H2 G 21 2H2 G 21 -2.149 13.143 -3.853 236 2H2* G 21 1H2* G 21 -8.600 15.644 -5.628 237 1H2* G 21 2H2* G 21 -8.900 15.057 -7.121 238 1H5* G 22 2H5* G 22 -8.081 14.395 -2.550 239 2H5* G 22 1H5* G 22 -8.904 15.220 -1.406 240 H4* G 22 H4* G 22 -6.762 15.467 -0.724 241 H3* G 22 H3* G 22 -7.819 17.731 -1.355 242 H1* G 22 H1* G 22 -4.359 16.859 -2.398 243 H8 G 22 HC8 G 22 -6.676 16.950 -5.318 244 H1 G 22 HN1 G 22 -0.554 15.817 -6.663 245 1H2 G 22 1H2 G 22 -0.148 15.863 -3.268 246 2H2 G 22 2H2 G 22 0.585 15.679 -4.826 247 H3T G 22 HO3 G 22 -6.250 18.630 -0.116 248 2H2* G 22 1H2* G 22 -5.663 18.770 -2.388 249 1H2* G 22 2H2* G 22 -6.775 18.121 -3.392 250 H17 PBO 23 H17 POB 23 -2.841 -2.474 2.651 251 H18 PBO 23 H18 POB 23 -5.348 -1.803 -0.536 252 H15 PBO 23 H15 POB 23 -1.255 -2.835 -1.346 253 H16 PBO 23 H16 POB 23 -0.899 -2.951 1.157 254 1H12 PBO 23 1H12 POB 23 -5.199 -0.943 -2.738 255 2H12 PBO 23 2H12 POB 23 -5.600 -2.679 -2.775 256 1H11 PBO 23 1H11 POB 23 -4.323 -2.669 -5.086 257 2H11 PBO 23 2H11 POB 23 -4.575 -0.900 -5.026 258 1H10 PBO 23 1H10 POB 23 -6.761 -1.126 -5.644 259 2H10 PBO 23 2H10 POB 23 -7.048 -2.371 -4.395
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