ソフトウェア | 名称 | バージョン | 分類 |
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PHENIX | phenix.refine: 1.9_1692精密化 | iMOSFLM | | データ削減 | Aimless | | データスケーリング | PHASER | | 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: 4HI2 解像度: 2.375→49.132 Å / SU ML: 0.33 / 交差検証法: THROUGHOUT / σ(F): 1.96 / 位相誤差: 24.62 / 立体化学のターゲット値: ML
| Rfactor | 反射数 | %反射 |
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Rfree | 0.241 | 3466 | 4.87 % |
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Rwork | 0.194 | 67774 | - |
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obs | 0.196 | 71240 | 99.15 % |
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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 |
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原子変位パラメータ | Biso max: 141.08 Å2 / Biso mean: 41.4702 Å2 / Biso min: 18.39 Å2 |
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精密化ステップ | サイクル: LAST / 解像度: 2.375→49.132 Å
| タンパク質 | 核酸 | リガンド | 溶媒 | 全体 |
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原子数 | 8606 | 0 | 342 | 658 | 9606 |
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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_d0.002 | 9071 | X-RAY DIFFRACTION | f_angle_d0.504 | 12240 | X-RAY DIFFRACTION | f_chiral_restr0.02 | 1273 | X-RAY DIFFRACTION | f_plane_restr0.002 | 1548 | X-RAY DIFFRACTION | f_dihedral_angle_d14.268 | 3238 | | | | | |
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LS精密化 シェル | Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 25 解像度 (Å) | Rfactor Rfree | Num. reflection Rfree | Rfactor Rwork | Num. reflection Rwork | Num. reflection all | % reflection obs (%) |
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2.3753-2.4078 | 0.3239 | 78 | 0.305 | 2271 | 2349 | 83 | 2.4078-2.4422 | 0.3007 | 166 | 0.2959 | 2749 | 2915 | 100 | 2.4422-2.4787 | 0.3231 | 134 | 0.2846 | 2714 | 2848 | 100 | 2.4787-2.5174 | 0.3732 | 88 | 0.2826 | 2746 | 2834 | 100 | 2.5174-2.5587 | 0.2887 | 134 | 0.2826 | 2766 | 2900 | 100 | 2.5587-2.6028 | 0.3261 | 210 | 0.2596 | 2710 | 2920 | 100 | 2.6028-2.6501 | 0.2859 | 152 | 0.2556 | 2685 | 2837 | 100 | 2.6501-2.7011 | 0.2639 | 150 | 0.2458 | 2704 | 2854 | 100 | 2.7011-2.7562 | 0.3026 | 108 | 0.2311 | 2777 | 2885 | 100 | 2.7562-2.8162 | 0.2583 | 180 | 0.2249 | 2726 | 2906 | 100 | 2.8162-2.8817 | 0.3037 | 176 | 0.2248 | 2634 | 2810 | 100 | 2.8817-2.9537 | 0.2876 | 138 | 0.2125 | 2760 | 2898 | 100 | 2.9537-3.0336 | 0.2937 | 156 | 0.2153 | 2735 | 2891 | 100 | 3.0336-3.1228 | 0.2783 | 118 | 0.202 | 2749 | 2867 | 100 | 3.1228-3.2236 | 0.224 | 162 | 0.1848 | 2755 | 2917 | 100 | 3.2236-3.3388 | 0.2274 | 140 | 0.1769 | 2710 | 2850 | 100 | 3.3388-3.4724 | 0.2662 | 124 | 0.1944 | 2752 | 2876 | 100 | 3.4724-3.6304 | 0.195 | 168 | 0.1896 | 2684 | 2852 | 99 | 3.6304-3.8218 | 0.2917 | 139 | 0.2027 | 2724 | 2863 | 99 | 3.8218-4.0611 | 0.3179 | 110 | 0.1813 | 2735 | 2845 | 100 | 4.0611-4.3745 | 0.1645 | 128 | 0.1385 | 2786 | 2914 | 100 | 4.3745-4.8144 | 0.1388 | 158 | 0.1198 | 2684 | 2842 | 100 | 4.8144-5.5102 | 0.1772 | 126 | 0.1492 | 2749 | 2875 | 100 | 5.5102-6.9392 | 0.2235 | 113 | 0.1774 | 2784 | 2897 | 100 | 6.9392-49.1421 | 0.2039 | 110 | 0.1766 | 2685 | 2795 | 98 |
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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 | 6.7896 | -3.8143 | 1.9874 | 6.4971 | -1.2056 | 6.2003 | -0.2018 | 0.1304 | -0.0884 | 0.5552 | 0.1448 | 0.0678 | -0.233 | -0.0665 | 0.1634 | 0.3244 | -0.0504 | -0.0601 | 0.2061 | -0.0443 | 0.246 | -28.4409 | -33.6321 | -39.2539 | 2 | 0.8448 | -0.3842 | 0.1625 | 1.3256 | -0.753 | 2.5534 | -0.031 | 0.0105 | -0.0543 | 0.0064 | -0.0974 | -0.0562 | 0.0634 | -0.1157 | 0.0944 | 0.3391 | -0.0636 | -0.022 | 0.2163 | -0.0207 | 0.3293 | -23.4848 | -31.1643 | -33.4576 | 3 | 6.6716 | -0.2891 | 0.9496 | 2.5048 | -0.6363 | 2.639 | -0.0941 | 0.2949 | -0.0354 | -0.2084 | 0.1349 | -0.224 | 0.1585 | 0.0331 | -0.0252 | 0.3772 | -0.0975 | 0.0053 | 0.2378 | -0.0372 | 0.2624 | -25.5945 | -32.1526 | -39.361 | 4 | 5.6841 | -0.4019 | 0.7148 | 5.5845 | 1.5489 | 4.379 | 0.0862 | -0.0972 | -0.3152 | 0.5488 | -0.2867 | 0.0443 | 0.7478 | 0.1356 | 0.0428 | 0.3638 | 0.0768 | -0.0387 | 0.3021 | -0.025 | 0.3436 | -1.4067 | -28.8488 | -20.5579 | 5 | 3.223 | 1.5562 | 0.5141 | 2.1707 | 0.3888 | 1.9641 | 0.1501 | 0.0659 | -0.2186 | -0.0811 | 0.1446 | -0.298 | 0.1825 | 0.1783 | -0.2557 | 0.2696 | 0.0206 | -0.03 | 0.3247 | 0.0015 | 0.258 | -4.9212 | -20.0866 | -24.3972 | 6 | 3.219 | -0.8448 | -1.5958 | 8.7666 | -2.9227 | 9.2297 | 0.0728 | 0.1525 | -0.3346 | -0.441 | -0.1695 | 0.0418 | 1.0391 | 0.4194 | 0.1206 | 0.3574 | 0.0179 | -0.0583 | 0.427 | -0.1019 | 0.3164 | -1.3712 | -28.5478 | -27.1507 | 7 | 3.6273 | 2.2804 | -3.2461 | 6.7138 | -3.312 | 8.1645 | -0.1897 | -0.1567 | 0.0322 | 0.2306 | 0.0688 | -0.4216 | 0.418 | 0.2246 | 0.0427 | 0.2474 | -0.0342 | -0.0632 | 0.3141 | -0.0866 | 0.302 | -2.6612 | -25.7535 | -18.2113 | 8 | 3.3739 | 1.4967 | -0.3394 | 5.1863 | 2.1723 | 5.5751 | 0.0038 | -0.2624 | 0.2168 | -0.2151 | 0.1059 | -0.4297 | -0.0027 | -0.0659 | -0.2354 | 0.4778 | -0.1153 | 0.0325 | 0.3063 | 0.0287 | 0.3371 | -12.2537 | -2.9722 | -40.6632 | 9 | 2.3682 | 0.2782 | 0.6925 | 0.8155 | -0.6474 | 3.0765 | -0.0592 | 0.156 | 0.0579 | 0.0924 | 0.1505 | 0.0011 | -0.2583 | 0.0201 | -0.1376 | 0.3283 | -0.0817 | -0.0022 | 0.272 | 0.0162 | 0.2881 | -17.4673 | -9.232 | -38.7975 | 10 | 5.8191 | 5.6504 | 0.5778 | 7.4992 | 1.8177 | 3.7488 | -0.2143 | 0.0933 | -0.6037 | -0.8299 | 0.3484 | -0.5398 | -0.2394 | 0.2189 | -0.1545 | 0.3692 | -0.0246 | 0.0958 | 0.2242 | 0.0197 | 0.2889 | -8.4089 | -10.8815 | -44.0944 | 11 | 5.1223 | 1.8484 | 1.839 | 7.5808 | 5.4793 | 4.0932 | -0.2258 | 0.7935 | 0.5263 | -1.8861 | 0.0471 | 0.5265 | -0.8892 | -0.7753 | 0.129 | 0.5974 | -0.122 | -0.0157 | 0.6029 | 0.0692 | 0.2534 | -15.6552 | -4.7017 | -49.9496 | 12 | 5.1592 | 0.841 | 1.5705 | 6.9623 | 2.0036 | 3.7634 | 0.0364 | -0.6746 | 0.3237 | 0.2659 | -0.0654 | -0.2478 | 0.4156 | -0.248 | 0.1008 | 0.3332 | 0.0215 | 0.0148 | 0.3257 | 0.0307 | 0.2137 | -15.3644 | -1.1379 | -31.6834 | 13 | 4.2829 | -0.4788 | 0.2947 | 7.7876 | 1.1339 | 3.6811 | 0.1817 | 0.3894 | -0.7333 | -0.5986 | -0.0088 | -0.2582 | -0.1062 | -0.1875 | -0.2513 | 0.4476 | -0.1115 | 0.0042 | 0.4351 | 0.009 | 0.4555 | -39.4407 | -7.3958 | -43.5634 | 14 | 3.1982 | 0.7288 | 0.1844 | 6.18 | 0.9945 | 3.384 | -0.22 | 0.1454 | 0.1565 | 0.036 | 0.2843 | 0.1937 | -0.2159 | -0.0381 | -0.0819 | 0.2895 | 0.0122 | -0.0021 | 0.3423 | 0.0535 | 0.2376 | -41.8036 | -1.9928 | -33.1432 | 15 | 3.0538 | -3.2394 | -2.6588 | 8.6811 | 4.2238 | 3.0136 | 0.1802 | 1.3457 | -0.0895 | -0.8444 | -0.4784 | 1.5185 | 0.3736 | -1.1332 | 0.3198 | 0.492 | -0.0484 | -0.1564 | 0.6213 | 0.0173 | 0.4992 | -49.1982 | -6.8907 | -41.2659 | 16 | 4.529 | -1.4591 | -5.2561 | 4.8843 | 1.4177 | 9.1899 | -0.2673 | 1.0046 | 0.885 | -0.6057 | 0.4995 | 0.1104 | -0.2033 | -0.6378 | -0.0554 | 0.3826 | -0.0339 | -0.0842 | 0.4788 | 0.0345 | 0.4001 | -48.0562 | 3.519 | -38.0696 | 17 | 7.7952 | -2.3422 | -4.2492 | 5.3303 | 2.0943 | 6.7776 | -0.1314 | 0.2344 | -0.2822 | 0.1296 | 0.2887 | -0.4134 | -0.1661 | 0.4355 | -0.2095 | 0.3798 | -0.1029 | -0.0046 | 0.315 | -0.0071 | 0.3826 | -33.2531 | -8.3065 | -37.8079 | 18 | 4.4034 | 5.0081 | -2.2284 | 8.5579 | -4.5972 | 4.3525 | 0.5745 | -0.1641 | 0.3565 | 0.502 | -0.5551 | 0.4592 | -0.4695 | 0.4464 | -0.013 | 0.3106 | 0.0511 | 0.104 | 0.4161 | -0.0602 | 0.3155 | -51.1893 | 1.91 | -9.3316 | 19 | 0.6959 | 0.9954 | 0.107 | 2.0728 | -1.0116 | 3.2358 | 0.004 | 0.0473 | -0.019 | -0.0531 | -0.0859 | 0.0298 | -0.0763 | -0.1746 | 0.0798 | 0.2687 | -0.0228 | 0.068 | 0.3608 | -0.0527 | 0.3138 | -49.2531 | -5.994 | -11.5415 | 20 | 7.4306 | 3.5644 | 0.8736 | 3.8702 | 3.4608 | 4.358 | 0.0008 | 0.1707 | 0.8612 | -0.4339 | -0.1742 | 0.8 | -0.5415 | -0.6257 | 0.3751 | 0.3872 | 0.1326 | 0.0152 | 0.4875 | 0.0435 | 0.3821 | -57.2797 | -0.6478 | -16.1209 | 21 | 2.6803 | 2.3018 | 2.9217 | 3.3607 | 5.2305 | 8.3579 | -0.1118 | -0.8412 | 0.3375 | -0.2357 | -0.3755 | 1.2718 | -0.6325 | -1.2439 | 0.2495 | 0.3494 | 0.0396 | 0.1074 | 0.4942 | -0.0088 | 0.5581 | -59.2737 | -2.9287 | -5.5994 | 22 | 6.4546 | 6.0856 | 1.9542 | 7.287 | 1.0986 | 4.8196 | -0.1464 | 0.3253 | -0.0271 | -0.8421 | -0.1195 | -0.4016 | -0.429 | 0.2725 | 0.1082 | 0.27 | 0.03 | 0.0218 | 0.3844 | 0.0109 | 0.2637 | -41.8646 | 1.4721 | -9.2692 | 23 | 3.1448 | -0.6372 | 0.0907 | 3.1798 | 0.6062 | 4.6504 | 0.026 | -0.1524 | -0.099 | 0.1773 | 0.1317 | 0.3624 | 0.6826 | -0.6988 | 0.0762 | 0.3814 | -0.0286 | -0.0352 | 0.3526 | -0.0218 | 0.371 | -51.3207 | -30.1422 | -21.76 | 24 | 1.5938 | -0.3725 | 0.0268 | 1.6285 | 2.7886 | 5.3022 | -0.1096 | 0.0507 | 0.0329 | 0.0125 | 0.1198 | 0.0373 | 0.1486 | -0.1048 | -0.001 | 0.3289 | -0.0761 | -0.0147 | 0.2967 | -0.0021 | 0.2953 | -46.842 | -24.2798 | -25.7254 | 25 | 3.382 | 0.7918 | -0.485 | 5.6201 | -1.5555 | 2.6953 | -0.1377 | 0.3675 | -0.0392 | -0.0343 | 0.1896 | 0.7268 | 0.3767 | -1.3692 | -0.0118 | 0.3113 | -0.0681 | -0.006 | 0.3819 | -0.0348 | 0.4622 | -57.4615 | -23.5844 | -24.6605 | 26 | 7.4404 | -2.4297 | -0.2549 | 5.4482 | -4.8433 | 6.5264 | -0.4968 | 0.4766 | -0.9663 | 0.0183 | 0.1988 | 0.9273 | 0.8465 | -0.6569 | -0.0621 | 0.4762 | -0.2364 | 0.0537 | 0.5444 | -0.0791 | 0.4332 | -54.3366 | -31.9863 | -31.0974 | 27 | 3.0561 | -0.8621 | -0.9785 | 3.6007 | -4.5322 | 7.3193 | -0.3557 | 0.0371 | 0.1087 | 0.158 | 0.4488 | 0.249 | -0.1083 | -0.0297 | -0.2432 | 0.3377 | -0.0532 | -0.0471 | 0.3297 | -0.0279 | 0.3661 | -43.4175 | -29.0616 | -16.6185 | 28 | 6.3149 | -1.417 | 1.7526 | 4.8426 | -0.3951 | 3.7682 | 0.3345 | -0.308 | -0.5685 | 0.6083 | -0.2665 | -0.372 | 0.0177 | 0.3154 | 0.0771 | 0.4524 | -0.064 | -0.009 | 0.4721 | 0.0303 | 0.3818 | -26.0184 | 0.4194 | 9.8503 | 29 | 7.5356 | -1.5233 | 0.5041 | 3.4024 | -0.2445 | 4.2703 | 0.1801 | -0.3933 | 0.5125 | -0.0262 | -0.1413 | 0.018 | -0.1962 | -0.1128 | -0.0866 | 0.324 | -0.0214 | 0.028 | 0.2654 | -0.0216 | 0.2255 | -29.9214 | 5.9764 | -1.8471 | 30 | 5.5759 | -0.6751 | 2.5179 | 8.6596 | -1.5206 | 7.8936 | 0.0962 | -0.5668 | 0.3304 | 0.7779 | -0.1135 | -0.121 | -0.6132 | 0.2963 | 0.0515 | 0.3618 | -0.0616 | 0.0062 | 0.4503 | -0.0675 | 0.3042 | -26.3633 | 9.0846 | 6.0434 | 31 | 2.2897 | -1.8097 | 0.8253 | 7.5321 | -4.9794 | 3.4974 | 0.4189 | 0.2675 | -0.1699 | -0.1195 | -0.0769 | -0.1814 | 0.3757 | 0.1127 | -0.4202 | 0.2877 | -0.0138 | 0.0298 | 0.3899 | -0.0223 | 0.3833 | -28.3067 | -5.4539 | 4.1505 | 32 | 7.3162 | -0.1661 | -3.1443 | 1.4998 | 0.8015 | 4.028 | -0.1527 | 0.0153 | 0.2048 | 0.1273 | -0.0251 | 0.3008 | -0.0856 | -0.2077 | 0.1842 | 0.4198 | 0.069 | -0.001 | 0.2876 | 0.0466 | 0.373 | -28.6553 | 15.0934 | -23.8168 | 33 | 2.2361 | 0.5851 | 0.9019 | 0.9445 | 0.5212 | 3.1596 | 0.0221 | -0.218 | 0.0465 | -0.0337 | 0.0755 | -0.004 | -0.286 | -0.0658 | -0.1094 | 0.3312 | -0.0251 | 0.0071 | 0.3195 | 0.0804 | 0.3265 | -22.3231 | 9.5312 | -22.1403 | 34 | 7.3859 | -3.6515 | 2.6805 | 7.1309 | -0.9553 | 3.1813 | -0.2608 | -0.2912 | 0.6776 | 0.4177 | 0.0338 | -0.1655 | -0.6341 | -0.2149 | 0.1548 | 0.4804 | 0.0159 | 0.0242 | 0.3247 | -0.016 | 0.3023 | -22.9496 | 19.1858 | -17.5253 | 35 | 5.2357 | 1.074 | 4.3814 | 6.5511 | -0.2433 | 3.8904 | -0.2738 | -0.1652 | 0.8486 | -0.9077 | -0.2464 | -0.1315 | -0.927 | 0.1167 | 0.3783 | 0.5063 | 0.009 | 0.0136 | 0.3071 | 0.0808 | 0.4723 | -19.7982 | 19.7785 | -28.0143 | 36 | 4.1815 | 0.6143 | 1.0302 | 2.5449 | 1.1715 | 5.3486 | -0.114 | -0.1604 | 0.04 | 0.2311 | -0.1534 | 0.2263 | -0.0722 | -0.1542 | 0.1583 | 0.3326 | -0.0655 | -0.029 | 0.373 | 0.0456 | 0.3417 | -32.5306 | 6.888 | -24.4105 | 37 | 2.202 | -0.4865 | -1.2637 | 4.1706 | -0.4563 | 8.1915 | -0.0037 | 0.1201 | 0.1164 | -0.4177 | -0.3467 | -0.0923 | -0.336 | 0.7854 | 0.1637 | 0.3291 | 0.0113 | -0.0783 | 0.4244 | -0.0138 | 0.4109 | -0.4107 | -0.7805 | -11.8687 | 38 | 1.1357 | 0.3167 | 1.3392 | 1.8366 | -0.4986 | 2.6901 | 0.0907 | -0.0568 | 0.0066 | -0.0296 | -0.0705 | -0.1311 | -0.0728 | 0.2553 | -0.127 | 0.213 | -0.0394 | -0.028 | 0.38 | -0.0123 | 0.291 | -7.711 | -1.6728 | -7.9366 | 39 | 9.0698 | -1.6643 | -4.7928 | 4.4206 | 2.5965 | 3.8219 | 0.3272 | -0.064 | 1.0645 | 0.1514 | 0.1418 | -0.5812 | -0.888 | 0.6961 | -0.5599 | 0.325 | -0.0469 | -0.0277 | 0.3244 | 0.0241 | 0.4844 | -3.0528 | 7.8879 | -8.997 | 40 | 1.5535 | -0.7762 | -1.7214 | 5.8082 | 3.3423 | 6.0306 | 0.1984 | -0.1311 | -0.1627 | -0.1156 | -0.1335 | -0.3635 | -0.0715 | 0.244 | -0.1742 | 0.2649 | -0.0015 | -0.0427 | 0.4176 | 0.0507 | 0.3464 | -2.3579 | -3.934 | -11.6616 | 41 | 6.2695 | -4.1562 | -2.4257 | 3.6427 | 0.6688 | 4.6866 | 0.3498 | 0.2062 | 0.2258 | 0.1859 | -0.5282 | -0.2735 | 0.0793 | -0.1959 | 0.2249 | 0.2277 | -0.0467 | -0.0566 | 0.4394 | -0.0351 | 0.2132 | -9.2588 | -21.644 | 6.1119 | 42 | 0.4047 | -0.5533 | -0.9505 | 2.6974 | 0.7194 | 2.5344 | 0.0043 | 0.0885 | -0.0334 | -0.1267 | -0.1387 | -0.0772 | -0.045 | 0.0392 | 0.1507 | 0.2223 | 0.0116 | -0.034 | 0.3798 | 0.0029 | 0.2901 | -13.3992 | -25.3479 | -0.2051 | 43 | 5.1705 | 3.3581 | 1.8678 | 7.2459 | 3.5351 | 6.4259 | 0.1501 | -0.8731 | 0.028 | 0.6728 | -0.4012 | -0.2301 | 0.1771 | -0.6004 | 0.2151 | 0.397 | 0.0532 | -0.0387 | 0.6473 | 0.0607 | 0.2629 | -13.9404 | -26.3634 | 11.5527 | 44 | 6.2423 | 2.3303 | 2.5492 | 7.2868 | 5.2837 | 6.0548 | 0.2695 | -0.1621 | -0.9929 | 0.7233 | 0.1432 | -0.6659 | 0.6973 | 0.6736 | -0.3655 | 0.2459 | 0.0231 | 0.0121 | 0.3767 | 0.045 | 0.3193 | -7.7229 | -32.2568 | 5.2207 | 45 | 4.8613 | 1.4002 | -0.7415 | 8.305 | 0.1346 | 0.9951 | 0.182 | 0.0012 | 0.4604 | -0.3769 | -0.234 | 0.4871 | -0.3518 | -0.1942 | 0.0158 | 0.2233 | -0.0562 | 0.0442 | 0.3913 | -0.005 | 0.2897 | -12.1167 | -14.5565 | 0.2922 | 46 | 7.115 | 1.884 | 2.9403 | 3.7413 | -0.8044 | 3.3603 | 0.0902 | 0.1329 | -0.2649 | -0.1295 | -0.1421 | 0.1378 | 0.5741 | 0.6124 | 0.0451 | 0.4214 | 0.0717 | -0.0031 | 0.2712 | -0.0259 | 0.2693 | -26.4838 | -43.2334 | -13.0883 | 47 | 2.5845 | 0.4569 | 0.6453 | 1.8463 | 0.5232 | 0.9734 | 0.0946 | 0.1503 | -0.3287 | 0.0086 | 0.0027 | -0.0174 | 0.1888 | 0.1528 | -0.0281 | 0.3213 | -0.0458 | -0.0016 | 0.3007 | -0.0318 | 0.2849 | -32.2996 | -35.8935 | -9.2792 | 48 | 6.45 | -2.5587 | -4.2703 | 4.9812 | 0.7081 | 9.0033 | -0.1955 | -0.5114 | -0.196 | 0.4509 | 0.0759 | -0.3436 | 0.9577 | 0.7385 | 0.1983 | 0.4892 | 0.0021 | -0.0836 | 0.3513 | -0.0107 | 0.3425 | -26.7284 | -43.1723 | -6.5203 | 49 | 8.6062 | 0.0051 | -4.1227 | 4.1425 | -0.7588 | 4.277 | 0.0703 | 0.1474 | -0.5612 | -0.1691 | -0.2221 | -0.0202 | 0.2199 | 0.2013 | 0.1012 | 0.3765 | -0.0248 | -0.1121 | 0.3736 | 0.0148 | 0.3408 | -28.5668 | -40.6032 | -15.3586 | 50 | 2.153 | 0.3132 | -0.6788 | 3.7901 | 0.0774 | 2.1258 | 0.0092 | -0.0884 | 0.1007 | -0.0776 | 0.0976 | 0.1933 | -0.0192 | -0.1817 | -0.0419 | 0.2206 | -0.0127 | 0.0112 | 0.4263 | 0.0134 | 0.214 | -37.6637 | -20.0839 | 5.4732 | 51 | 5.048 | -0.0797 | 1.3509 | 4.4919 | -1.3774 | 3.8029 | -0.1828 | -0.3277 | -0.1564 | 0.0648 | 0.1304 | 0.0783 | 0.0297 | -0.0982 | 0.0027 | 0.2434 | 0.003 | 0.0796 | 0.2829 | -0.0237 | 0.235 | -40.5544 | -22.5427 | 7.3277 |
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精密化 TLSグループ | ID | Refine-ID | Refine TLS-ID | Selection details | Auth asym-ID | Auth seq-ID |
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1 | X-RAY DIFFRACTION | 1 | chain 'A' and (resid 2 through 13 )A2 - 13 | 2 | X-RAY DIFFRACTION | 2 | chain 'A' and (resid 14 through 51 )A14 - 51 | 3 | X-RAY DIFFRACTION | 3 | chain 'A' and (resid 52 through 91 )A52 - 91 | 4 | X-RAY DIFFRACTION | 4 | chain 'B' and (resid 1 through 13 )B1 - 13 | 5 | X-RAY DIFFRACTION | 5 | chain 'B' and (resid 14 through 43 )B14 - 43 | 6 | X-RAY DIFFRACTION | 6 | chain 'B' and (resid 44 through 69 )B44 - 69 | 7 | X-RAY DIFFRACTION | 7 | chain 'B' and (resid 70 through 91 )B70 - 91 | 8 | X-RAY DIFFRACTION | 8 | chain 'C' and (resid 1 through 13 )C1 - 13 | 9 | X-RAY DIFFRACTION | 9 | chain 'C' and (resid 14 through 51 )C14 - 51 | 10 | X-RAY DIFFRACTION | 10 | chain 'C' and (resid 52 through 69 )C52 - 69 | 11 | X-RAY DIFFRACTION | 11 | chain 'C' and (resid 70 through 77 )C70 - 77 | 12 | X-RAY DIFFRACTION | 12 | chain 'C' and (resid 78 through 91 )C78 - 91 | 13 | X-RAY DIFFRACTION | 13 | chain 'D' and (resid 1 through 10 )D | | | | | | | | | | | | | | | | | | | | | | | | | |
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