ソフトウェア | 名称 | バージョン | 分類 |
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SBC-Collect | | データ収集 | HKL-3000 | | データ収集 | HKL-3000 | | 位相決定 | PHENIX | | モデル構築 | PHENIX | (phenix.refine: dev_851)精密化 | HKL-3000 | | データ削減 | HKL-3000 | | データスケーリング | PHENIX | | 位相決定 | |
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精密化 | 構造決定の手法: 分子置換 開始モデル: PDBID 2Z3B 解像度: 2.498→41.076 Å / Isotropic thermal model: mixed / 交差検証法: THROUGHOUT / σ(F): 0 / 位相誤差: 26.26 / 立体化学のターゲット値: TWIN_LSQ_F
| Rfactor | 反射数 | %反射 | Selection details |
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Rfree | 0.204 | 2114 | 5.05 % | random |
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Rwork | 0.165 | - | - | - |
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all | 0.166 | 41861 | - | - |
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obs | 0.166 | 41861 | 99.63 % | - |
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溶媒の処理 | 減衰半径: 0.9 Å / VDWプローブ半径: 1.11 Å / 溶媒モデル: FLAT BULK SOLVENT MODEL / Bsol: 93.909 Å2 / ksol: 0.367 e/Å3 |
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原子変位パラメータ | Biso mean: 86 Å2
| Baniso -1 | Baniso -2 | Baniso -3 |
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1- | -14.8826 Å2 | -0 Å2 | -3.9106 Å2 |
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2- | - | 11.6083 Å2 | 0 Å2 |
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3- | - | - | 3.2743 Å2 |
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精密化ステップ | サイクル: LAST / 解像度: 2.498→41.076 Å
| タンパク質 | 核酸 | リガンド | 溶媒 | 全体 |
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原子数 | 8063 | 0 | 30 | 61 | 8154 |
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拘束条件 | Refine-ID | タイプ | Dev ideal | 数 |
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X-RAY DIFFRACTION | f_bond_d0.007 | 8200 | X-RAY DIFFRACTION | f_angle_d1.101 | 11031 | X-RAY DIFFRACTION | f_dihedral_angle_d15.404 | 2958 | X-RAY DIFFRACTION | f_chiral_restr0.085 | 1252 | X-RAY DIFFRACTION | f_plane_restr0.004 | 1418 | | | | | |
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LS精密化 シェル | Refine-ID: X-RAY DIFFRACTION 解像度 (Å) | Rfactor Rfree | Num. reflection Rfree | Rfactor Rwork | Num. reflection Rwork | Num. reflection obs | % reflection obs (%) |
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2.4987-2.5568 | 0.4032 | 143 | 0.3485 | 2639 | 2782 | 94 | 2.5568-2.6206 | 0.343 | 124 | 0.3256 | 2604 | 2728 | 95 | 2.6206-2.6913 | 0.3647 | 122 | 0.3178 | 2689 | 2811 | 96 | 2.6913-2.7703 | 0.3471 | 142 | 0.301 | 2606 | 2748 | 95 | 2.7703-2.8595 | 0.352 | 145 | 0.3045 | 2650 | 2795 | 95 | 2.8595-2.9614 | 0.3224 | 146 | 0.2837 | 2662 | 2808 | 95 | 2.9614-3.0795 | 0.2963 | 138 | 0.2692 | 2637 | 2775 | 95 | 3.0795-3.2192 | 0.3068 | 135 | 0.2511 | 2630 | 2765 | 95 | 3.2192-3.3882 | 0.2543 | 144 | 0.215 | 2697 | 2841 | 95 | 3.3882-3.5993 | 0.2502 | 158 | 0.1919 | 2594 | 2752 | 94 | 3.5993-3.8755 | 0.2121 | 158 | 0.1644 | 2647 | 2805 | 94 | 3.8755-4.2622 | 0.1651 | 146 | 0.1371 | 2637 | 2783 | 94 | 4.2622-4.8716 | 0.1318 | 128 | 0.1017 | 2651 | 2779 | 95 | 4.8716-6.1098 | 0.1522 | 139 | 0.1205 | 2669 | 2808 | 95 | 6.1098-20.3154 | 0.1446 | 140 | 0.0986 | 2684 | 2824 | 94 |
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精密化 TLS | 手法: refined / Refine-ID: X-RAY DIFFRACTION ID | L11 (°2) | L12 (°2) | L13 (°2) | L22 (°2) | L23 (°2) | L33 (°2) | S11 (Å °) | S12 (Å °) | S13 (Å °) | S21 (Å °) | S22 (Å °) | S23 (Å °) | S31 (Å °) | S32 (Å °) | S33 (Å °) | T11 (Å2) | T12 (Å2) | T13 (Å2) | T22 (Å2) | T23 (Å2) | T33 (Å2) | Origin x (Å) | Origin y (Å) | Origin z (Å) |
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1 | 1.8364 | -0.9589 | 0.3171 | 1.5162 | -0.7665 | 6.7356 | 0.0436 | 0.3483 | 0.0125 | -0.1479 | 0.1955 | -0.0694 | 0.0974 | 0.0286 | 0.704 | 1.0267 | -0.0628 | -0.0126 | 0.4687 | 0.0895 | 0.2349 | 26.0531 | -18.7067 | -22.0512 | 2 | 4.8991 | 2.2658 | -0.7024 | 2.021 | -1.2372 | 2.0329 | 0.3176 | -0.5349 | -0.1601 | 0.1712 | -0.035 | -0.2687 | 0.2129 | 0.0412 | -0.2437 | 0.8387 | -0.1575 | -0.1303 | 0.3168 | -0.0966 | 0.1936 | 31.3619 | -18.0438 | -17.4962 | 3 | 6.9246 | 1.0459 | -4.3631 | 7.5838 | -4.5572 | 7.573 | 1.197 | -0.8343 | -0.2458 | 0.4931 | -0.62 | -0.1875 | -0.9548 | -0.967 | -0.4517 | 0.9622 | -0.009 | -0.0585 | 0.7934 | 0.2672 | 0.3532 | 15.5844 | -24.8256 | -9.752 | 4 | 4.1518 | 0.7542 | 2.7107 | 4.612 | 0.6748 | 1.7947 | -0.1882 | -0.8513 | 0.0786 | 0.3606 | -0.2486 | -0.0951 | -0.0765 | -0.4713 | 0.4683 | 0.7872 | -0.1231 | -0.1073 | 0.6768 | 0.1085 | 0.2348 | 15.5802 | -15.097 | -11.2081 | 5 | 6.8566 | 1.3888 | 1.1425 | 8.4125 | -2.7469 | 3.5817 | 0.5037 | -0.565 | -0.3282 | 0.3108 | -0.6155 | 0.1458 | 0.5957 | -0.4303 | 0.0375 | 0.7705 | -0.1876 | -0.1516 | 0.8022 | 0.1186 | 0.2764 | 6.0937 | -14.0013 | -16.7832 | 6 | 2.4994 | -2.352 | -2.257 | 4.37 | 3.8363 | 4.2324 | 0.0826 | -0.2613 | 0.2828 | -1.7789 | 0.9505 | 0.2515 | -1.1239 | -0.3346 | -0.9 | 0.9976 | -0.0884 | -0.0836 | 0.6362 | 0.1984 | 0.3766 | 16.5606 | -7.6738 | -18.106 | 7 | 2.1679 | -0.8875 | -0.6616 | 1.8257 | -0.0072 | 1.7767 | 0.2847 | 0.3832 | -0.1124 | -0.5685 | -0.3288 | 0.1687 | -0.04 | -0.1119 | -0.0153 | 0.8534 | -0.077 | -0.1929 | 0.6625 | 0.1697 | 0.2963 | 14.7204 | -19.5314 | -24.9716 | 8 | 7.8719 | 1.5156 | -0.6982 | 6.5676 | 0.2004 | 8.4253 | -0.2932 | 0.0063 | -0.8483 | 0.1562 | 0.4323 | 0.051 | 1.0442 | 0.2797 | -0.2318 | 0.8108 | 0.0271 | -0.0323 | 0.4402 | -0.0203 | 0.1703 | 27.6616 | -28.7161 | -29.7091 | 9 | 8.6189 | 5.644 | -6.2188 | 5.7659 | -4.8277 | 5.0097 | 0.762 | -0.2687 | 0.2098 | 0.1781 | -0.4637 | 0.4815 | 0.0183 | 0.6391 | 0.0119 | 0.8994 | -0.1201 | -0.1874 | 0.5035 | 0.2011 | 0.4681 | 31.5361 | -22.7543 | -19.8224 | 10 | 7.9423 | 0.8378 | 4.8011 | 3.357 | -0.8946 | 5.9971 | -0.0408 | 0.4391 | -0.0106 | 0.3241 | 0.2261 | -0.144 | -0.685 | 1.2268 | -0.0891 | 0.8813 | -0.1852 | -0.0744 | 0.6323 | -0.0582 | 0.2264 | 3.231 | -8.0065 | -40.1783 | 11 | 2.4734 | 1.2664 | -1.8051 | 2.8942 | -0.5891 | 1.3668 | -0.2866 | -0.4257 | -0.6178 | -0.1487 | 0.4996 | 0.3394 | 0.6325 | -0.4155 | 0.1086 | 0.7326 | -0.1017 | -0.106 | 0.3905 | 0.1979 | 0.205 | 0.7986 | -12.1084 | -40.7033 | 12 | 6.6343 | 0.3926 | -3.9827 | 1.7859 | -0.1186 | 2.5756 | 0.2416 | -0.0742 | 0.2589 | -0.336 | 0.1005 | 0.0201 | -0.1692 | -0.3012 | -0.2755 | 0.8291 | 0.0788 | -0.0051 | 0.4414 | 0.1669 | 0.2276 | 11.876 | -15.662 | -34.5942 | 13 | 2.9791 | 3.4457 | 2.137 | 5.4965 | 0.5624 | 3.9454 | -0.3867 | -0.9142 | -0.8133 | 1.5078 | 0.5925 | 0.781 | 2.4937 | -1.1368 | 0.0076 | 1.5143 | 0.0141 | 0.4327 | 0.8281 | 0.1713 | 0.9446 | -11.0539 | -10.9886 | -30.4974 | 14 | 7.3835 | 0.6944 | 5.0415 | 3.1558 | -0.7188 | 7.2358 | 0.0251 | -1.5722 | -0.1408 | 0.4446 | 0.2715 | 0.3604 | -0.7324 | -1.2604 | -0.1334 | 0.777 | -0.0974 | -0.0457 | 0.8367 | 0.1776 | 0.2407 | -4.1097 | -4.7901 | -26.9073 | 15 | 5.7925 | 5.8129 | 1.0999 | 7.5281 | 2.8916 | 5.1392 | 0.9 | 0.2052 | 2.8335 | 1.6233 | -0.3831 | 0.6724 | 1.1723 | -0.1851 | -0.4501 | 1.0613 | 0.3005 | 0.1403 | 0.8114 | 0.0398 | 0.8068 | -8.8656 | 5.3635 | -28.6523 | 16 | 8.6389 | -2.2528 | 1.2836 | 1.3749 | -1.2706 | 2.732 | 0.03 | 0.0891 | 1.0067 | 0.4606 | 0.1943 | 0.1663 | 0.2896 | -0.3207 | -0.1795 | 0.6898 | -0.0864 | -0.0135 | 0.4325 | 0.1573 | 0.4344 | -1.4753 | 0.6355 | -32.578 | 17 | 5.569 | -2.0751 | 2.7699 | 3.4588 | 2.0094 | 6.281 | -0.6861 | 0.013 | 0.3634 | -0.1585 | 1.146 | 0.3964 | -0.5382 | -0.4185 | -0.0375 | 0.7089 | -0.1754 | -0.035 | 0.6135 | 0.2323 | 0.4846 | -1.7084 | 1.9582 | -40.8435 | 18 | 5.8925 | -1.9708 | 0.0256 | 5.8317 | 1.16 | 6.4723 | -0.2957 | 0.8861 | 0.1754 | -0.9971 | -0.1935 | 0.6573 | 0.3758 | -0.4669 | 0.6819 | 0.6144 | -0.1587 | -0.1034 | 0.4453 | 0.0882 | 0.271 | -2.3124 | -6.8301 | -54.0236 | 19 | 2.0001 | 3.6684 | 5.2309 | 5.8686 | 2.2791 | 8.496 | -0.7614 | 0.4735 | -1.5272 | 0.1304 | 0.9853 | -0.0999 | 1.9773 | 0.0368 | -0.164 | 0.9861 | -0.011 | 0.0064 | 0.3979 | 0.0401 | 0.367 | 1.6021 | -13.9426 | -49.1511 | 20 | 5.1685 | 1.322 | -3.7868 | 2.7205 | 1.0186 | 4.429 | -0.8892 | -0.1253 | -0.8544 | 0.2275 | 0.8938 | 0.5307 | 0.9897 | -0.3789 | 1.231 | 0.9313 | -0.1039 | -0.0238 | 0.6396 | 0.343 | 0.4872 | 3.3604 | -14.9911 | -41.9117 | 21 | 4.4663 | 0.2123 | -2.793 | 1.8671 | 1.2111 | 2.8321 | -0.3293 | -0.4092 | -0.1696 | 0.1152 | 0.6032 | 0.4356 | 0.3989 | -1.0984 | -0.3757 | 0.7817 | -0.137 | -0.0386 | 0.8231 | 0.1593 | 0.1756 | -3.4757 | 23.886 | -46.5976 | 22 | 7.1696 | -4.2325 | -6.1901 | 7.0443 | 2.1149 | 5.8654 | -1.432 | 0.5131 | 0.8672 | -0.208 | 0.535 | 0.2503 | 1.5389 | -0.3106 | 0.1873 | 1.3654 | -0.1652 | -0.3997 | 0.4786 | 0.0148 | 0.6474 | -0.4394 | 9.4584 | -45.7892 | 23 | 9.8749 | -0.943 | -4.3057 | 3.2787 | 2.9196 | 3.856 | -0.4701 | -2.2808 | -0.3579 | 0.9463 | -0.2684 | 2.1111 | 0.8724 | -2.0675 | 0.576 | 0.6507 | 0.0197 | 0.0147 | 1.5423 | 0.0891 | 0.968 | -15.6964 | 25.5186 | -36.9322 | 24 | 1.7204 | -1.0507 | 2.4093 | 7.768 | 3.0295 | 6.213 | 0.566 | -0.5014 | -0.4664 | 1.1871 | -0.8615 | 0.9887 | 0.9591 | -1.5298 | 0.4993 | 1.0122 | -0.4226 | 0.0113 | 0.9809 | -0.0752 | 0.3375 | -8.0143 | 22.2511 | -31.2334 | 25 | 5.43 | -2.2381 | 2.5748 | 2.1549 | -2.649 | 5.6463 | 0.5115 | -1.7183 | 0.2267 | 0.1253 | 0.3127 | 0.3221 | 0.8762 | -1.9998 | -0.718 | 0.9245 | -0.394 | 0.0612 | 1.0991 | -0.0505 | 0.4568 | -4.6989 | 31.5535 | -26.3328 | 26 | 6.0131 | -4.3429 | 0.2413 | 3.8698 | 0.1338 | 4.3146 | 0.4903 | -0.715 | 0.5671 | 0.2257 | -0.3977 | -0.6411 | 0.4528 | 0.4288 | -0.1279 | 0.6321 | -0.1433 | -0.0451 | 0.4871 | 0.034 | 0.238 | 2.0059 | 21.8705 | -30.2927 | 27 | 3.7019 | -0.4567 | 0.5988 | 3.9601 | 0.3017 | 6.7783 | -0.0461 | 0.0176 | 0.4136 | -0.217 | -0.5208 | 0.0636 | -0.9109 | 0.443 | 0.5075 | 0.6945 | 0.0306 | -0.0466 | 0.4033 | 0.0172 | 0.1849 | -0.608 | 32.4065 | -38.6874 | 28 | 3.2463 | 0.0045 | 0.9456 | 6.9529 | -1.0972 | 6.1793 | -0.0408 | 0.0194 | 0.0997 | -0.8496 | 0.1139 | 0.1111 | 0.1298 | -1.1981 | 0.0059 | 0.67 | -0.0197 | -0.0823 | 0.5341 | 0.2016 | 0.2224 | -0.8699 | 30.4193 | -54.8896 | 29 | 3.752 | -0.6037 | -0.3418 | 2.6417 | 1.3619 | 6.7787 | -0.1756 | 1.0789 | 0.2036 | -0.0653 | 0.2006 | 0.1238 | 0.3766 | -1.7747 | 0.0216 | 0.9011 | -0.3969 | -0.1951 | 0.9611 | 0.3156 | 0.4851 | -3.7861 | 19.3414 | -49.9667 | 30 | 6.87 | -2.1567 | 2.1551 | 2.9352 | -2.4144 | 6.6146 | 0.02 | 0.4407 | 0.2034 | -0.7201 | -0.2555 | 0.0327 | 1.0992 | 1.0824 | 0.1719 | 0.9035 | -0.0413 | 0.066 | 0.7739 | 0.0569 | 0.3594 | 40.6522 | 42.6646 | -39.5472 | 31 | 5.3284 | -3.7184 | 3.2004 | 4.5089 | -5.9765 | 9.3199 | -0.4693 | -0.7023 | 0.5514 | -0.335 | 0.4167 | -0.2714 | 0.1675 | 0.1277 | -0.1615 | 0.5381 | -0.1506 | -0.0732 | 0.7797 | -0.0356 | 0.4863 | 46.1564 | 42.0959 | -34.8749 | 32 | 6.669 | -3.7239 | 2.3612 | 3.8514 | -3.4806 | 3.6412 | -0.4084 | 0.9673 | 1.2718 | -0.8067 | 0.4356 | -0.9329 | 0.9717 | -0.1794 | 0.0669 | 0.7144 | -0.1301 | -0.096 | 0.8106 | 0.2968 | 0.6712 | 51.2708 | 48.8023 | -51.9588 | 33 | 5.0954 | -1.4174 | 4.2182 | 8.0584 | -3.1604 | 4.1061 | -0.1555 | 0.6684 | -0.0947 | 0.2467 | -0.0848 | -0.1026 | -0.7031 | 0.8424 | 0.1488 | 0.461 | -0.0591 | -0.0412 | 0.5605 | 0.2233 | 0.3671 | 49.594 | 39.1119 | -51.7352 | 34 | 5.798 | 2.0344 | 2.546 | 6.2206 | -2.3332 | 3.0079 | -0.7992 | 1.6072 | 0.3241 | -0.4634 | 1.3474 | 0.0532 | -0.3081 | -0.4737 | -0.4632 | 0.696 | -0.092 | -0.0712 | 0.9134 | 0.0947 | 0.2929 | 42.6077 | 38.0186 | -60.1158 | 35 | 3.6187 | -1.1853 | 0.0197 | 9.4916 | -2.725 | 5.8108 | 0.4454 | 0.2502 | -0.3671 | 0.0525 | -0.1419 | 0.1858 | 0.6285 | -0.022 | -0.3431 | 0.5558 | -0.1391 | -0.1875 | 0.6779 | 0.0532 | 0.3192 | 41.5326 | 37.3415 | -50.8633 | 36 | 3.1988 | -2.1625 | -0.9294 | 4.8773 | 3.599 | 3.279 | 0.1094 | 0.5642 | 0.3566 | -0.074 | -0.146 | 0.2349 | 0.1031 | 0.1417 | -0.0477 | 0.717 | -0.0341 | -0.0252 | 0.4683 | 0.1945 | 0.2825 | 34.3463 | 41.3784 | -48.472 | 37 | 9.0852 | 1.4718 | -0.7434 | 8.8608 | 0.5689 | 9.0883 | -0.095 | -1.0761 | -0.2855 | 0.2315 | -0.838 | -0.3855 | -1.0606 | -0.7671 | 0.8841 | 0.6561 | 0.0151 | -0.1581 | 0.7887 | 0.0681 | 0.5065 | 30.2797 | 53.5061 | -38.8515 | 38 | 4.8789 | -2.2566 | 0.2172 | 5.5463 | -1.3034 | 5.1378 | 0.2661 | -0.9885 | -0.2789 | 0.88 | 0.6355 | -0.2714 | -0.5656 | 0.0832 | -0.5507 | 0.7186 | -0.0434 | -0.1855 | 0.7349 | -0.0221 | 0.3467 | 38.1472 | 51.5805 | -33.7611 | 39 | 5.9048 | 1.196 | -0.3684 | 4.0156 | -3.2737 | 2.7734 | -0.0982 | -0.4471 | 0.2731 | 0.701 | 0.3167 | -0.2703 | -0.7117 | 0.8744 | -0.378 | 0.8107 | 0.0669 | -0.113 | 0.8115 | -0.1418 | 0.472 | 43.9904 | 46.7719 | -34.5524 | 40 | 2.2042 | -0.359 | 0.9907 | 3.4275 | 2.2435 | 4.6175 | 0.2336 | -0.0656 | 0.1504 | -0.0946 | 0.4708 | -0.0189 | -0.0676 | 0.106 | -0.5626 | 0.7398 | -0.1598 | 0.0117 | 0.5146 | 0.1816 | 0.2843 | 16.7427 | 33.2271 | -62.4712 | 41 | 6.4724 | 1.3618 | 1.5845 | 4.4166 | 2.4241 | 2.298 | 0.0571 | -0.4243 | 1.3022 | -0.1879 | -0.3732 | -0.0037 | 0.0838 | -0.2129 | 0.341 | 0.424 | -0.1049 | 0.0012 | 0.5256 | 0.0453 | 0.5401 | 26.3213 | 37.8968 | -58.0636 | 42 | 5.4979 | 1.3198 | 6.0964 | 4.9367 | -0.2461 | 7.3923 | 0.2757 | 0.9447 | 0.2644 | -1.0444 | -0.3067 | -0.9427 | -0.8271 | 0.6577 | -0.0319 | 0.6684 | 0.0589 | 0.0646 | 0.9185 | 0.076 | 0.3366 | 30.416 | 28.509 | -69.5274 | 43 | 5.6727 | 0.532 | 1.1621 | 3.7262 | 0.4318 | 4.3893 | 0.72 | 0.5228 | -0.843 | -0.0801 | -0.1357 | -0.5215 | 0.6582 | 0.5466 | -0.353 | 0.6652 | -0.0391 | -0.1954 | 0.4752 | 0.0701 | 0.2005 | 24.0348 | 21.5881 | -66.6908 | 44 | 3.8792 | 0.6257 | -1.0414 | 2.1551 | 0.1258 | 3.0689 | 0.0954 | 0.1231 | 0.2179 | -0.233 | -0.145 | -0.167 | -0.5437 | -0.1568 | -0.9915 | 0.724 | -0.1435 | -0.0897 | 0.6851 | 0.3259 | 0.2911 | 4.3022 | 30.9155 | -61.7404 | 45 | 3.1799 | -1.0712 | 5.4275 | 6.0272 | -1.8523 | 9.4759 | -0.0827 | 0.1504 | 1.6029 | 0.1816 | -0.7338 | 0.4588 | -0.7929 | 0.0853 | 0.8167 | 0.7687 | -0.0722 | 0.0312 | 0.5859 | 0.0969 | 0.5653 | 9.8599 | 37.9113 | -58.8639 | 46 | 6.5763 | -0.175 | -4.154 | 4.8262 | 2.2404 | 3.5643 | 0.868 | 0.0322 | 1.1978 | -0.0999 | 0.2703 | 0.0098 | -1.1217 | 0.338 | -0.6012 | 0.691 | 0.0003 | -0.1053 | 0.3597 | 0.0198 | 0.5902 | 17.251 | 38.9759 | -58.3807 | 47 | 5.7725 | 3.9428 | -0.7746 | 4.266 | 0.1713 | 0.5406 | 0.0617 | -0.4197 | 1.0144 | 0.5072 | -0.6471 | 0.3234 | 0.3582 | 0.0002 | 0.5887 | 0.8085 | -0.2496 | -0.2127 | 0.7433 | 0.0384 | 0.5229 | 13.7501 | 1.229 | -61.6611 | 48 | 5.1078 | 0.4936 | -1.0993 | 8.9447 | 1.786 | 2.2539 | 0.5758 | 0.3551 | 0.8218 | -0.0875 | -0.5658 | 0.1141 | 0.0674 | 0.6162 | 0.125 | 0.6606 | -0.1544 | -0.0692 | 0.7638 | 0.0973 | 0.345 | 11.6558 | 8.0434 | -63.4739 | 49 | 4.118 | 2.2203 | -4.8691 | 7.1834 | -0.5594 | 6.4708 | -0.7649 | 1.3802 | 0.6208 | -1.3671 | -0.1986 | -0.5765 | -0.9541 | 1.2337 | 0.8043 | 1.0313 | -0.2828 | -0.2647 | 1.2939 | 0.4364 | 0.6506 | 19.0949 | -1.5292 | -77.9245 | 50 | 3.6558 | -0.7012 | 2.3446 | 1.9184 | -0.4873 | 1.5172 | -0.4658 | 0.9468 | -0.3815 | -0.8569 | -0.2627 | -0.1627 | 0.5357 | -0.4927 | 0.6886 | 1.1403 | -0.1588 | 0.143 | 1.0158 | -0.0418 | 0.3013 | 25.8961 | 1.7566 | -71.3544 | 51 | 6.4287 | -1.3362 | -1.1726 | 6.7571 | 1.2682 | 6.8674 | 0.2338 | 0.9731 | -0.7225 | -0.5466 | -0.2068 | -1.3358 | 1.3492 | 0.0389 | 0.2446 | 0.8647 | 0.106 | 0.2325 | 0.4814 | -0.0651 | 0.7049 | 31.2346 | -7.4053 | -68.853 | 52 | 9.2904 | 4.4053 | 1.27 | 8.4524 | 0.5558 | 7.3963 | -0.7004 | 0.887 | 0.9374 | -0.1648 | 0.7579 | -0.1894 | -0.1695 | 0.6203 | -0.0636 | 0.654 | 0.0378 | -0.1208 | 0.7634 | 0.1297 | 0.5335 | 28.3813 | 2.176 | -61.7773 | 53 | 6.2462 | 0.0061 | -3.2015 | 3.8839 | 0.1047 | 5.8792 | 0.0025 | 0.7443 | -0.3149 | -0.089 | 0.0363 | -0.395 | 1.7386 | -0.1944 | -0.0018 | 0.9219 | 0.0315 | -0.1615 | 0.5567 | 0.0038 | 0.3462 | 19.772 | -8.3273 | -62.8686 | 54 | 9.4422 | -1.556 | -4.0343 | 7.9851 | -2.8374 | 3.3108 | -0.4127 | -0.5101 | -0.8703 | -0.081 | -0.2045 | 0.03 | 0.6222 | -1.0083 | 0.6411 | 0.7538 | -0.0602 | -0.0832 | 0.6823 | -0.0126 | 0.3345 | 4.0319 | -10.3398 | -59.304 | 55 | 1.4952 | -2.1628 | -1.8036 | 7.8598 | 5.0773 | 6.8506 | -0.4224 | 0.9791 | 0.269 | 0.1603 | -0.5177 | 0.7685 | 0.3454 | -1.2978 | 0.6876 | 0.5934 | -0.2981 | -0.0802 | 0.735 | 0.193 | 0.5598 | 3.1976 | -0.949 | -61.7927 | 56 | 7.6517 | -6.073 | -7.5809 | 4.8577 | 6.1232 | 7.813 | 0.6317 | 1.4084 | 0.6884 | -0.6473 | -0.8607 | -0.1833 | -0.5597 | -1.5297 | -0.1711 | 0.8717 | -0.0414 | -0.0092 | 0.5797 | 0.1248 | 0.4687 | 8.0224 | 4.7096 | -64.1219 |
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精密化 TLSグループ | ID | Refine-ID | Refine TLS-ID | Selection details |
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1 | X-RAY DIFFRACTION | 1 | chain 'A' and (resseq 1:13)2 | X-RAY DIFFRACTION | 2 | chain 'A' and (resseq 14:39)3 | X-RAY DIFFRACTION | 3 | chain 'A' and (resseq 40:47)4 | X-RAY DIFFRACTION | 4 | chain 'A' and (resseq 48:72)5 | X-RAY DIFFRACTION | 5 | chain 'A' and (resseq 73:90)6 | X-RAY DIFFRACTION | 6 | chain 'A' and (resseq 91:104)7 | X-RAY DIFFRACTION | 7 | chain 'A' and (resseq 105:131)8 | X-RAY DIFFRACTION | 8 | chain 'A' and (resseq 132:166)9 | X-RAY DIFFRACTION | 9 | chain 'A' and (resseq 167:179)10 | X-RAY DIFFRACTION | 10 | chain 'B' and (resseq 2:13)11 | X-RAY DIFFRACTION | 11 | chain 'B' and (resseq 14:27)12 | X-RAY DIFFRACTION | 12 | chain 'B' and (resseq 28:39)13 | X-RAY DIFFRACTION | 13 | chain 'B' and (resseq 40:47)14 | X-RAY DIFFRACTION | 14 | chain 'B' and (resseq 48:72)15 | X-RAY DIFFRACTION | 15 | chain 'B' and (resseq 73:90)16 | X-RAY DIFFRACTION | 16 | chain 'B' and (resseq 91:112)17 | X-RAY DIFFRACTION | 17 | chain 'B' and (resseq 113:131)18 | X-RAY DIFFRACTION | 18 | chain 'B' and ( | | | | | | | | | | | | | | | | | |
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