Software Name Version Classification PHENIX(dev_2386: ???)refinement XDSdata reduction XSCALEdata scaling MOLREPphasing
Refinement Method to determine structure : MOLECULAR REPLACEMENTStarting model : 1vqyResolution : 1.65→43.426 Å / SU ML : 0.21 / Cross valid method : FREE R-VALUE / σ(F) : 1.35 / Phase error : 25.48 Rfactor Num. reflection % reflection Rfree 0.2505 1992 1.56 % Rwork 0.2059 - - obs 0.2066 127461 99.7 %
Solvent computation Shrinkage radii : 0.9 Å / VDW probe radii : 1.11 ÅRefinement step Cycle : LAST / Resolution : 1.65→43.426 ÅProtein Nucleic acid Ligand Solvent Total Num. atoms 7740 0 24 1089 8853
Refine LS restraints Refine-ID Type Dev ideal Number X-RAY DIFFRACTION f_bond_d0.006 8173 X-RAY DIFFRACTION f_angle_d0.911 11151 X-RAY DIFFRACTION f_dihedral_angle_d13.918 5023 X-RAY DIFFRACTION f_chiral_restr0.052 1162 X-RAY DIFFRACTION f_plane_restr0.007 1484
LS refinement shell Resolution (Å)Rfactor Rfree Num. reflection Rfree Rfactor Rwork Num. reflection Rwork Refine-ID % reflection obs (%)1.6501-1.6913 0.2917 125 0.2614 8965 X-RAY DIFFRACTION 100 1.6913-1.7371 0.2845 142 0.252 8888 X-RAY DIFFRACTION 100 1.7371-1.7882 0.2742 132 0.2434 8959 X-RAY DIFFRACTION 100 1.7882-1.8459 0.2975 131 0.2412 8936 X-RAY DIFFRACTION 100 1.8459-1.9119 0.2586 131 0.2377 9001 X-RAY DIFFRACTION 100 1.9119-1.9884 0.2738 141 0.2234 8896 X-RAY DIFFRACTION 100 1.9884-2.0789 0.2715 149 0.2152 8981 X-RAY DIFFRACTION 100 2.0789-2.1885 0.2559 152 0.2099 8907 X-RAY DIFFRACTION 100 2.1885-2.3256 0.2582 144 0.2158 8976 X-RAY DIFFRACTION 100 2.3256-2.5052 0.2527 157 0.2083 8925 X-RAY DIFFRACTION 100 2.5052-2.7573 0.2503 148 0.2136 8944 X-RAY DIFFRACTION 100 2.7573-3.1561 0.269 144 0.2069 8958 X-RAY DIFFRACTION 99 3.1561-3.976 0.2306 143 0.1776 8998 X-RAY DIFFRACTION 99 3.976-43.4413 0.2103 153 0.175 9135 X-RAY DIFFRACTION 99
Refinement TLS params. Method : refined / Refine-ID : X-RAY DIFFRACTION
Show large table (25 x 65) Hide large table 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)1 3.8958 -0.3112 -1.1661 1.8626 -0.2351 3.3869 -0.1357 0.2026 -0.2714 -0.1751 -0.1265 -0.1426 0.4217 -0.0279 0.1514 0.1711 -0.0098 -0.0351 0.0442 0.0464 0.0765 12.2336 -4.8463 28.9673 2 4.8465 -3.2149 -0.3354 5.8511 0.4775 4.5746 -0.2231 -0.4978 0.0992 0.7471 0.3142 -0.4856 0.1071 0.252 -0.0955 0.1748 -0.0239 -0.0578 0.1442 -0.0102 0.122 15.9777 1.7514 47.4656 3 1.7879 0.6731 -0.0878 3.6695 -0.535 1.4087 0.0298 -0.1505 -0.2006 0.386 0.0943 -0.1045 0.1598 0.0448 -0.1148 0.143 -0.0166 -0.066 0.0848 0.0248 0.1448 17.1611 -8.5587 39.0574 4 0.6148 -0.1144 -0.3649 3.3993 0.2586 1.4986 -0.0141 -0.0305 -0.1163 0.1258 0.0735 -0.0044 0.1931 -0.0235 -0.0477 0.08 -0.0272 -0.0557 0.092 0.0137 0.1062 11.4347 -6.668 33.2287 5 1.6757 1.4649 -0.6114 1.9477 0.5422 1.9717 0.0852 -0.1991 -0.0789 0.4167 -0.1486 -0.0288 0.014 -0.0554 0.0418 0.4154 -0.0841 0.0404 0.1401 0.0362 0.1011 7.1573 -8.8978 48.3388 6 1.7273 -0.9703 -1.9421 1.5233 2.1797 5.3437 -0.0191 0.0709 -0.0765 0.0008 -0.0778 -0.0453 -0.0026 -0.1682 0.0191 0.1345 -0.0042 -0.0448 0.0165 -0.0011 0.0362 10.0421 -0.8302 30.6884 7 0.3767 0.7344 -1.6371 2.898 -3.9519 7.531 -0.1295 -0.1669 -0.4512 0.0187 0.0687 0.3187 0.2694 -0.4074 0.0709 0.187 0.0286 -0.0318 0.1777 0.0419 0.3428 22.1931 -13.0025 25.4008 8 5.1413 -0.2189 -3.8079 7.1408 1.2796 2.9956 0.4378 -0.928 -0.7606 0.9851 -0.2786 -0.8337 0.5196 0.7032 -0.1542 0.5653 0.0083 -0.1923 0.3284 0.13 0.5226 23.0635 -17.8672 38.1259 9 3.1606 -1.0758 1.7598 3.0863 -1.3401 3.8763 0.0243 -0.2682 -0.0808 0.1876 -0.092 -0.2844 -0.0395 0.2136 0.032 0.0276 -0.0197 -0.0307 0.1385 0.0339 0.2165 22.1999 5.0972 27.1954 10 6.6994 -1.3001 -1.5835 2.2416 0.4476 4.7525 0.1282 0.5791 -0.3535 -0.4258 0.0198 -0.0047 0.2543 -0.0515 -0.1233 0.2257 -0.0069 -0.0222 0.1048 -0.0344 0.149 15.3606 1.508 9.105 11 2.1763 1.1113 -0.1394 0.5827 -0.2404 1.5758 -0.0843 0.1684 -0.0362 -0.11 0.0287 -0.1875 0.0693 0.2405 -0.0327 0.0363 -0.0081 -0.0146 0.1298 -0.0329 0.2726 25.9205 0.1519 17.1253 12 1.0079 0.5145 -0.2138 0.5367 -0.1274 1.0492 0.0268 -0.0362 -0.179 -0.1495 0.0804 -0.2382 0.1137 0.0795 -0.0589 0.0786 -0.0196 -0.0574 0.0902 -0.0125 0.1611 17.4143 2.2749 22.8467 13 2.642 0.1511 -1.4777 0.3074 -0.506 1.4269 0.0488 0.0254 0.0106 -0.0144 0.0551 -0.0441 -0.0761 0.2753 0.0122 0.0278 -0.0561 -0.037 0.1982 0.021 0.3911 32.8272 10.6641 23.0149 14 4.0266 3.4492 2.9268 3.4807 1.3973 5.5694 -0.2127 0.8529 0.2561 -0.4893 0.1252 -0.3857 -0.2998 0.4728 0.0911 0.2296 -0.0284 0.0454 0.1794 0.042 0.2039 26.499 9.9133 7.8721 15 3.9675 -2.0349 5.4237 1.9968 -3.0741 8.5668 -0.1654 -0.193 0.2281 -0.0479 -0.0928 -0.1148 0.1649 -0.3658 0.258 0.0816 -0.0117 -0.0052 0.0514 -0.0204 0.112 16.5315 10.264 20.9348 16 1.9484 0.6589 -1.0948 1.474 -0.2322 3.925 -0.0113 0.0514 -0.4403 -0.1503 0.0789 -0.4499 0.322 0.496 -0.0335 0.1047 0.0276 -0.0575 0.2345 -0.0281 0.416 30.4591 -4.6181 27.4693 17 6.1741 1.9711 -3.6548 4.5316 -1.6593 5.3319 -0.063 0.0783 0.1274 -0.1466 -0.0343 -0.4316 -0.1736 0.4885 0.0374 0.1097 -0.0536 -0.0447 0.1318 0.0138 0.1407 20.9181 22.8155 34.4793 18 6.8981 0.1661 0.7605 0.1812 -0.0866 0.7697 -0.0929 -0.5387 0.4906 0.3191 0.0091 -0.0053 -0.1956 0.0342 0.0951 0.4701 -0.0302 0.0316 0.1332 -0.0723 0.1292 10.1508 27.6579 50.1104 19 2.4994 -0.4517 0.9547 1.3621 -0.2788 2.7075 0.0474 -0.1508 0.0228 0.1794 0.0115 -0.2442 0.019 0.3833 -0.0714 0.1807 -0.0447 -0.0608 0.1195 -0.0102 0.1447 21.6771 24.6656 41.2719 20 7.764 -3.2702 1.9098 4.3439 -2.0531 1.5778 -0.0637 -0.9995 -0.3284 0.5566 -0.0985 -0.184 0.3069 0.4042 0.1339 0.4098 0.0156 -0.0787 0.3394 0.0519 0.1457 20.2974 18.8143 53.7857 21 3.0841 0.4211 -4.0037 2.0319 -0.2357 6.461 -0.1136 0.1216 -0.0421 0.4163 0.0108 -0.0016 0.1551 -0.0467 0.0511 0.1566 -0.0497 -0.0407 0.1148 -0.0153 0.0781 13.0769 17.4843 40.2495 22 1.0378 -0.0402 0.775 1.7348 1.918 2.7728 0.086 -0.2129 0.1997 0.1694 0.0606 -0.4353 -0.3477 0.4857 -0.2266 0.225 -0.1443 -0.0374 0.2943 -0.0147 0.2581 28.7745 31.3777 32.036 23 2.5612 0.4057 2.236 4.5385 1.1031 2.0812 0.0882 -0.4111 0.3613 0.4819 0.1044 -0.3344 -0.185 0.0763 -0.1537 0.8324 -0.1837 -0.157 0.7571 -0.0858 0.5892 30.546 35.6862 50.0457 24 0.7415 0.2461 -0.1064 2.051 -0.3 0.5776 0.0509 -0.1667 0.0826 0.4089 -0.0712 -0.0342 -0.3107 0.0484 -0.0452 0.293 -0.1175 0.0071 -0.0408 0.046 0.0856 12.3986 33.0349 29.3183 25 1.583 1.1968 0.3053 5.2632 -0.6554 0.7465 -0.0486 0.328 -0.0743 -0.4708 0.2108 -0.4983 -0.2647 0.4927 -0.096 0.2023 -0.0483 0.0441 0.1813 -0.0263 0.1517 21.4767 26.8255 13.1802 26 1.6953 0.9639 -0.2583 3.6154 -1.0054 0.2797 -0.0439 0.1168 0.0485 -0.2312 0.1 -0.1214 -0.0329 0.0128 0.1095 0.306 -0.1183 0.0022 0.0551 0.0331 0.1571 19.6169 40.336 18.6317 27 0.0376 0.0849 0.0033 4.0795 0.2222 0.2448 0.0446 0.0008 0.1011 0.0452 -0.0323 -0.2844 -0.1571 0.1674 -0.0347 0.1731 -0.0437 -0.0111 0.1199 -0.0112 0.1422 20.0119 26.1858 25.2734 28 0.5138 -0.7264 -0.1062 2.2588 -0.2128 0.134 0.0847 0.0178 0.1777 -0.0748 0.0837 -0.0661 -0.2188 0.0638 0.047 0.2849 -0.1084 -0.0049 0.0633 -0.0007 0.127 10.9806 39.6499 25.7204 29 0.1162 -0.246 0.0683 0.8822 -0.3208 0.6475 0.0653 0.0525 0.0295 -0.2429 -0.0734 -0.014 -0.1635 -0.0129 0.0506 0.4333 -0.0181 -0.033 0.1116 0.0661 0.0413 12.9933 37.1097 9.8474 30 0.5705 -0.3762 -0.2612 1.5061 0.991 3.1515 0.0812 -0.0159 0.0181 -0.0091 -0.0462 0.0887 -0.1127 0.0801 -0.0016 0.2116 -0.034 0.0053 0.0647 0.0108 0.0544 8.9484 26.9153 21.347 31 0.3647 -0.349 -0.2541 0.6403 -0.1204 0.6067 0.0114 0.0881 0.1764 0.205 0.0416 -0.3212 -0.2788 0.2547 0.0322 0.3689 -0.1426 -0.0247 0.1877 0.0067 0.2141 19.4175 39.5534 36.0547 32 4.1051 -1.7011 1.0531 4.6278 1.5578 1.2882 0.04 0.2905 0.4506 -0.3711 -0.0214 -0.8731 -0.5057 0.5369 -0.0181 0.4787 -0.2515 0.0189 0.5301 0.0534 0.5733 28.7938 46.6437 20.5115 33 2.4915 0.0019 0.6083 1.3486 -1.0607 1.2629 0.0433 0.1535 0.3489 -0.1358 -0.0735 -0.0125 -0.4858 -0.0426 0.041 0.3963 0.0546 0.0317 0.1005 0.0025 0.1032 -6.5727 32.4802 31.7554 34 4.1429 -3.3978 -0.5926 4.0752 2.605 3.5764 -0.1232 -0.4176 -0.3232 0.4588 0.1545 0.4455 0.0355 -0.1094 0.0179 0.2687 -0.0189 0.0502 0.1656 0.0116 0.1061 -15.5323 21.4549 45.525 35 1.0537 -0.2942 0.259 0.8417 0.8869 1.273 0.1564 -0.1085 0.1999 0.0441 -0.0884 0.0647 -0.2864 -0.1224 -0.0254 0.3165 0.034 0.0656 0.1255 -0.0146 0.1122 -14.807 34.1093 39.6953 36 1.3863 0.1425 -0.0278 0.3054 0.1873 1.7644 0.0715 -0.137 0.1804 0.4343 0.0125 0.0461 -0.1528 0.0219 -0.0705 0.1445 0.007 -0.0112 0.1167 -0.0027 0.0683 -7.7609 33.0606 36.0906 37 0.3674 0.2093 0.2973 1.2403 0.8756 1.7431 0.0129 -0.1733 0.0038 0.1394 0.0002 0.0167 0.1227 0.0235 0.0149 0.4978 0.0473 -0.0003 0.2199 -0.084 0.0448 -8.4444 30.7387 52.0232 38 1.1457 1.2341 -1.1903 3.7145 -4.7038 6.1447 0.0551 -0.091 -0.0055 -0.0104 -0.1599 -0.0943 -0.0859 0.1352 0.1001 0.2477 0.0192 0.0201 0.0695 0 0.092 -3.0971 24.6914 37.9639 39 2.6514 0.4402 -1.4712 0.3674 0.4358 2.379 0.1247 -0.1195 0.4741 0.0835 0.0655 0.278 -0.4224 -0.241 -0.1676 0.3273 0.1053 0.0442 0.1719 0.026 0.219 -14.086 40.3629 26.9831 40 1.7704 3.2804 0.7965 9.3312 -0.5796 1.6579 -0.3827 -0.4879 -0.0629 0.8508 0.0635 1.1898 0.2696 -0.525 0.3299 0.5773 0.1822 0.218 0.6037 0.0139 0.5306 -24.4473 40.4914 43.7378 41 8.6163 -0.0625 -4.9097 2.2707 0.6633 4.7238 -0.0007 -0.3087 -0.15 0.1223 0.0463 0.1955 -0.328 -0.2483 -0.0338 0.1079 0.0408 -0.0188 0.1606 0.0492 0.0905 -13.047 23.5887 22.5263 42 2.5341 -0.7267 1.7783 1.2051 -0.5504 1.2701 0.1412 0.4712 0.4185 -0.2811 0.0305 0.0295 -0.2295 -0.1689 -0.027 0.2845 0.0331 0.047 0.1887 0.0988 0.1645 -4.3029 32.9307 10.1167 43 2.2579 -0.6647 0.9751 1.1308 -0.226 1.7386 -0.0738 0.2223 0.1234 -0.1974 0.1258 0.0576 -0.2146 -0.1966 -0.0466 0.1676 -0.0019 0.0002 0.1223 0.051 0.0874 -12.0317 31.5767 17.7835 44 8.2682 2.5481 0.9494 3.941 -1.127 3.9433 0.0203 0.149 0.3482 -0.2826 0.079 0.3907 -0.0046 -0.4443 -0.0999 0.1744 0.0271 -0.0271 0.1122 0.0267 0.0642 -16.549 26.4399 21.873 45 1.5062 -0.7007 1.6109 3.4993 1.2135 6.745 0.2018 0.0977 -0.3573 0.052 0.0246 0.4904 0.3503 -0.7215 -0.2645 0.1916 -0.064 -0.1513 0.347 0.0829 0.2054 -24.4608 20.7017 15.5387 46 4.55 0.6653 1.9972 5.6635 1.7274 4.561 0.0679 0.6493 -0.2407 -0.2251 0.226 0.0911 0.4319 -0.3063 -0.2614 0.2361 -0.0063 -0.0898 0.375 0.0034 0.1656 -13.7434 24.8953 4.0857 47 5.2936 0.823 -4.1698 1.3841 -1.2821 5.2302 -0.1507 -0.0789 -0.1168 -0.1966 0.086 0.0278 0.1511 -0.1105 0.106 0.1053 -0.0194 -0.0488 0.1197 0.0382 0.084 -7.1695 20.3464 17.38 48 0.0731 0.0098 0.3331 0.9845 -0.8041 2.3447 0.0133 0.1684 0.4474 -0.266 0.0038 0.1919 -0.1089 -0.2699 -0.0828 0.2368 0.0934 -0.0198 0.2945 0.1279 0.2917 -23.0075 34.4281 23.4158 49 4.3461 -0.7916 1.6192 2.5727 -0.6848 2.2419 0.1311 0.1169 -0.058 -0.0533 -0.0432 0.2488 0.3494 -0.3011 -0.2175 0.113 -0.059 -0.006 0.1538 0.0236 0.0785 -13.9523 5.3897 28.6186 50 3.2124 0.2288 -0.883 1.6503 -0.5061 0.5721 0.1136 -0.4692 -0.4334 0.3168 0.0376 0.0606 0.2143 -0.1179 0.0725 0.3452 -0.0761 -0.0191 0.1785 0.0719 0.1577 -9.4755 -4.0554 42.9338 51 2.4319 0.1858 -0.004 0.8058 0.3882 0.8064 -0.0145 -0.2967 -0.2187 0.0006 0.0403 0.1263 0.2034 -0.2286 -0.0131 0.1577 -0.0668 -0.0335 0.1657 0.0476 0.1071 -14.3672 -2.302 33.5772 52 0.065 -0.104 -0.1502 0.8983 -0.0836 0.4879 0.0249 0.0117 0.0053 -0.0148 0.0131 0.1505 0.0593 -0.1169 -0.0062 -0.0359 -0.0973 -0.1179 0.2007 0.0393 0.125 -17.4988 3.0193 28.3464 53 1.9962 0.7319 -1.1209 0.8891 -0.5208 1.2667 0.0366 0.0412 0.0743 -0.0247 0.0479 0.1194 0.0184 -0.1207 0.0777 0.0423 -0.0947 -0.0252 0.273 -0.0049 0.2511 -26.2129 9.2813 31.8908 54 5.695 -4.5419 0.2113 4.9533 -0.9194 0.4311 -0.234 -1.0224 -0.2605 0.4462 0.3102 0.2754 0.109 -0.4522 -0.0444 0.1914 -0.047 0.026 0.3479 0.0305 0.1431 -20.3319 4.1209 45.9323 55 3.851 -0.9347 3.8487 0.8843 -0.9582 3.9312 -0.1989 0.0719 0.0936 0.2635 -0.0638 0.014 -0.2183 0.1436 0.1818 0.1198 -0.0441 -0.004 0.0989 0.0124 0.0659 -9.7131 8.3345 34.7896 56 0.5767 0.2029 0.0609 0.7878 0.0914 0.1754 0.1008 -0.0358 -0.2319 0.0655 -0.115 0.1788 0.0463 -0.0492 0.0313 0.1014 -0.1648 -0.0681 0.2967 -0.0076 0.2276 -22.3438 -1.9496 19.8955 57 3.678 2.2026 0.375 5.9775 0.7192 6.2916 0.1976 -0.3685 -0.6647 0.2952 -0.2415 0.4628 0.3027 -0.182 0.0871 0.362 -0.1294 0.0225 0.5389 0.1925 0.7044 -29.1303 -11.3 35.1434 58 3.4667 0.6506 -0.5818 3.6376 -1.5736 3.2153 -0.03 -0.1135 -0.4249 0.172 -0.0135 0.0988 0.3856 -0.0273 0.0404 0.1905 -0.0392 -0.0241 0.0901 -0.0054 0.0797 -5.4602 -3.5867 21.6277 59 2.1786 2.4959 0.0756 7.5738 4.574 5.4865 -0.158 0.4881 0.291 -0.673 0.1522 0.4442 -0.3376 -0.3006 0.0353 0.2561 -0.0066 -0.0428 0.2063 0.04 0.1025 -10.0125 7.6144 5.8306 60 1.1905 -0.0821 -0.3631 1.6246 1.3966 2.2896 0.0638 0.1631 -0.1154 -0.0048 -0.0253 0.0215 0.2624 -0.0412 -0.0471 0.1351 -0.0241 -0.0594 0.1403 -0.0019 0.0759 -9.9922 -1.7234 15.2298 61 3.8669 1.7547 -2.8813 3.051 -0.4947 2.4411 -0.1356 -0.3377 -0.3276 -0.29 0.1663 -0.3699 0.9516 0.6903 -0.0259 0.3245 0.0997 -0.0442 0.3301 -0.0922 0.1623 -0.12 -13.0149 14.9364 62 2.7469 -2.9249 -1.8447 5.5286 1.5734 2.7514 0.0298 0.252 -0.0996 -0.3003 -0.1557 0.0958 0.231 0.1709 0.1186 0.3438 -0.0431 -0.0027 0.2493 -0.0696 0.1207 -0.8343 -2.8767 2.2449 63 0.6284 1.182 -0.58 5.4083 -4.4949 4.7726 0.0164 0.1093 -0.0552 0.2027 -0.0761 -0.1493 -0.0426 0.0107 0.043 0.1384 -0.0461 -0.0494 0.128 -0.0001 0.0758 -0.4058 3.6788 17.5085 64 0.8931 -0.5218 0.1341 0.4662 -0.4536 0.9124 -0.0564 0.2085 -0.106 0.0247 0.0407 0.2693 0.4079 -0.1954 -0.0218 0.3619 -0.1431 -0.0249 0.1963 0.0241 0.2021 -14.095 -11.368 24.0861 65 1.8317 -0.6816 0.4113 0.4669 0.2187 0.7406 0.2308 0.3491 -0.268 -0.1028 -0.1093 0.5417 0.472 -0.3202 -0.0758 0.332 -0.2216 -0.1379 0.5707 0.0125 0.3853 -18.9515 -11.9137 5.632
Refinement TLS group Show large table (4 x 65) Hide large table ID Refine-ID Refine TLS-ID Selection details 1 X-RAY DIFFRACTION 1 chain 'A' and (resid -3 through 9 ) 2 X-RAY DIFFRACTION 2 chain 'A' and (resid 10 through 23 )3 X-RAY DIFFRACTION 3 chain 'A' and (resid 24 through 41 )4 X-RAY DIFFRACTION 4 chain 'A' and (resid 42 through 70 )5 X-RAY DIFFRACTION 5 chain 'A' and (resid 71 through 83 )6 X-RAY DIFFRACTION 6 chain 'A' and (resid 84 through 101 )7 X-RAY DIFFRACTION 7 chain 'A' and (resid 102 through 106 )8 X-RAY DIFFRACTION 8 chain 'A' and (resid 107 through 112 )9 X-RAY DIFFRACTION 9 chain 'B' and (resid -3 through 9 ) 10 X-RAY DIFFRACTION 10 chain 'B' and (resid 10 through 23 )11 X-RAY DIFFRACTION 11 chain 'B' and (resid 24 through 41 )12 X-RAY DIFFRACTION 12 chain 'B' and (resid 42 through 58 )13 X-RAY DIFFRACTION 13 chain 'B' and (resid 59 through 70 )14 X-RAY DIFFRACTION 14 chain 'B' and (resid 71 through 83 )15 X-RAY DIFFRACTION 15 chain 'B' and (resid 84 through 96 )16 X-RAY DIFFRACTION 16 chain 'B' and (resid 97 through 113 )17 X-RAY DIFFRACTION 17 chain 'C' and (resid -3 through 9 ) 18 X-RAY DIFFRACTION 18 chain 'C' and (resid 10 through 23 )19 X-RAY DIFFRACTION 19 chain 'C'