|||)) Welcome to CPL M0.15.9 |||\\ Renz Research, Inc. Loading the Space-group Database ... __________ \ ____ / \ \ / / \ \/ / \ / \/ Yield! .................................................... File /usr/local/rri/ccl/lib/symlib is open for read. ............................................................... The space-group #19 is loaded. File /usr/local/rri/ccl/lib/symlib read. SOURCE: cpl.io.coordinates.__init__ TYPE: result ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ Coordinates file: ./1A0C.pdb.sub ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ a = 85.66 angstrom b = 153.73 angstrom c = 158.47 angstrom alpha= 90 degree beta = 90 degree gamma= 90 degree P212121 orthorhombic No. 19 Positions: 4 position 1: x, y, z 1 0 0 0 0 1 0 0 0 0 1 0 position 2: -x+1/2, -y, z+1/2 -1 0 0 0.5 0 -1 0 0 0 0 1 0.5 position 3: -x, y+1/2, -z+1/2 -1 0 0 0 0 1 0 0.5 0 0 -1 0.5 position 4: x+1/2, -y+1/2, -z 1 0 0 0.5 0 -1 0 0.5 0 0 -1 0 437 AA or 49.818 kDa per monomer Input substructure ATOM 299 SD MET A 37 73.848 49.438 46.809 1.00 31.40 S ATOM 520 SD MET A 64 63.302 66.850 25.583 1.00 22.42 S ATOM 621 SD MET A 75 62.719 50.511 9.498 1.00 30.35 S ATOM 1009 SD MET A 124 70.488 49.008 13.692 1.00 27.96 S ATOM 1612 SD MET A 201 32.113 48.041 34.488 1.00 21.70 S ATOM 1725 SD MET A 214 42.724 34.639 21.780 1.00 18.15 S ATOM 2431 SD MET A 301 50.917 62.217 47.394 1.00 25.56 S ATOM 2557 SD MET A 316 56.853 58.596 50.000 1.00 46.94 S ATOM 2592 SD MET A 321 64.175 49.992 45.980 1.00 17.52 S ATOM 2645 SD MET A 327 59.072 41.172 46.219 1.00 23.21 S ATOM 2888 SD MET A 359 71.398 55.409 36.717 1.00 18.75 S ATOM 4080 SD MET B 37 7.397 54.711 41.289 1.00 31.40 S ATOM 4301 SD MET B 64 20.361 69.057 63.449 1.00 22.42 S ATOM 4402 SD MET B 75 18.345 51.926 78.565 1.00 30.35 S ATOM 4790 SD MET B 124 10.462 51.873 74.316 1.00 27.96 S ATOM 5393 SD MET B 201 48.356 46.238 53.379 1.00 21.70 S ATOM 5506 SD MET B 214 35.746 33.911 65.328 1.00 18.15 S ATOM 6212 SD MET B 301 32.016 63.842 41.369 1.00 25.56 S ATOM 6338 SD MET B 316 25.611 61.327 38.577 1.00 46.94 S ATOM 6373 SD MET B 321 17.036 53.729 42.118 1.00 17.52 S ATOM 6426 SD MET B 327 20.731 44.261 41.356 1.00 23.21 S ATOM 6669 SD MET B 359 10.674 59.648 51.700 1.00 18.75 S ATOM 7861 SD MET C 37 15.826 81.696 25.134 1.00 31.40 S ATOM 8082 SD MET C 64 37.697 64.275 16.018 1.00 22.42 S ATOM 8183 SD MET C 75 48.704 80.617 4.278 1.00 30.35 S ATOM 8571 SD MET C 124 40.090 82.129 2.347 1.00 27.96 S ATOM 9174 SD MET C 201 55.407 83.043 43.220 1.00 21.70 S ATOM 9287 SD MET C 214 55.748 96.461 26.682 1.00 18.15 S ATOM 9993 SD MET C 301 32.737 68.887 40.608 1.00 25.56 S ATOM 10119 SD MET C 316 26.551 72.515 38.684 1.00 46.94 S ATOM 10154 SD MET C 321 23.669 81.130 30.855 1.00 17.52 S ATOM 10207 SD MET C 327 27.371 89.943 34.392 1.00 23.21 S ATOM 10450 SD MET C 359 24.292 75.724 19.120 1.00 18.75 S ATOM 11642 SD MET D 37 69.555 76.384 64.609 1.00 31.40 S ATOM 11863 SD MET D 64 45.241 62.006 72.796 1.00 22.42 S ATOM 11964 SD MET D 75 36.815 79.119 85.531 1.00 30.35 S ATOM 12352 SD MET D 124 45.550 79.180 87.504 1.00 27.96 S ATOM 12955 SD MET D 201 30.719 84.827 46.832 1.00 21.70 S ATOM 13068 SD MET D 214 32.367 97.143 64.132 1.00 18.15 S ATOM 13774 SD MET D 301 50.948 67.244 48.494 1.00 25.56 S ATOM 13900 SD MET D 316 57.608 69.764 50.598 1.00 46.94 S ATOM 13935 SD MET D 321 61.741 77.361 58.905 1.00 17.52 S ATOM 13988 SD MET D 327 59.445 86.829 55.910 1.00 23.21 S ATOM 14231 SD MET D 359 60.252 71.433 70.305 1.00 18.75 S SOURCE: ncsymm.py TYPE: result ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 0 1 2 3 _____ _____ _____ _____ 2592 6373 13935 10154 299 4080 11642 7861 2645 6426 13988 10207 2888 6669 14231 10450 1009 4790 12352 8571 1612 5393 12955 9174 6212 2431 9993 13774 1725 5506 13068 9287 621 4402 11964 8183 6338 2557 10119 13900 8082 11863 4301 520 Sites in each row are related by NCS. Sites in each column belong to a rigid nominal monomer. Site 0 2592 64.1750 49.9920 45.9800 Polar 0.0000 0.0000 0.0000 Matrix 1.0000 0.0000 0.0000 0.0000 1.0000 -0.0000 -0.0000 0.0000 1.0000 Vector 0.0000 0.0000 0.0000 Site 1 6373 17.0360 53.7290 42.1180 Polar 175.2768 158.9506 179.9860 Matrix -0.9882 0.1532 0.0045 0.1532 0.9864 0.0589 0.0045 0.0589 -0.9983 Vector 72.5693 -8.1124 84.8034 Site 2 13935 61.7410 77.3610 58.9050 Polar 94.7230 -20.5239 180.0000 Matrix 0.7423 -0.1537 0.6522 -0.1537 -0.9864 -0.0575 0.6522 -0.0575 -0.7558 Vector -8.1935 139.1674 54.6818 Site 3 10154 23.6690 81.1300 30.8550 Polar -89.9569 -110.5274 180.0000 Matrix -0.7541 0.0005 -0.6568 0.0005 -1.0000 -0.0014 -0.6568 -0.0014 0.7541 Vector 102.2312 131.1364 38.3839 Sites not related by NCS: None Missing sites completed None ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~