*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 RMSD = 0.85 A TRANSFORM -0.7831 -0.4217 0.4571 0.3369 0.3302 0.8817 -0.5227 0.8445 -0.1165 57.531 -17.670 -32.222 A 67 ASP A 199 ASP^? A 68 ALA A 198 ALA^? A 72 LEU A 162 LEU^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.92 A TRANSFORM -0.5387 0.7060 -0.4597 -0.8255 -0.3334 0.4554 0.1683 0.6248 0.7625 -10.433 -59.636 -194.267 A 183 GLY A 118 GLY.? B 419 GLY A 148 GLY.? B 420 ALA A 115 ALA~? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 0.94 A TRANSFORM 0.5232 0.5481 -0.6526 -0.6175 0.7716 0.1529 0.5873 0.3230 0.7421 8.664 -125.874 -171.385 A 183 GLY A 118 GLY.? B 419 GLY A 148 GLY.? B 420 ALA A 147 ALA.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.00 A TRANSFORM 0.8409 0.5139 -0.1696 -0.1491 -0.0812 -0.9855 -0.5202 0.8540 0.0083 12.768 37.292 1.213 A 316 ALA A 218 ALA^? A 317 GLY A 129 GLY^? A 318 ASP A 127 ASP^? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.01 A TRANSFORM -0.1977 -0.8797 0.4325 0.9521 -0.2772 -0.1288 0.2332 0.3863 0.8924 175.767 37.969 -29.468 A 316 ALA A 218 ALA^? A 317 GLY A 129 GLY^? A 318 ASP A 127 ASP^? ULMNm 3 1grc_c02 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 RMSD = 1.03 A TRANSFORM 0.0903 -0.9912 -0.0968 0.4745 -0.0427 0.8792 -0.8756 -0.1253 0.4665 122.482 44.469 8.810 A 106 ASN A 205 ASN.? A 108 HIS A 153 HIS^? A 144 ASP A 107 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.03 A TRANSFORM -0.9887 -0.0773 0.1281 -0.0152 -0.7997 -0.6002 0.1488 -0.5954 0.7895 21.997 24.975 13.575 A 250 ALA A 218 ALA^? A 251 GLY A 129 GLY^? A 252 ASP A 127 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 6 3 RMSD = 1.03 A TRANSFORM 0.9146 -0.2014 0.3506 -0.4035 -0.5091 0.7603 0.0253 -0.8368 -0.5469 43.922 -89.627 -55.289 A 420 ALA A 115 ALA~? B 182 GLY A 146 GLY.? B 183 GLY A 118 GLY.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.04 A TRANSFORM -0.2024 0.7852 0.5852 0.9611 0.0445 0.2728 0.1882 0.6176 -0.7637 -25.579 -21.219 -64.830 B 250 ALA A 218 ALA^? B 251 GLY A 129 GLY^? B 252 ASP A 127 ASP^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 1.05 A TRANSFORM 0.3895 0.6650 -0.6372 -0.8189 -0.0666 -0.5701 -0.4216 0.7438 0.5186 -0.089 -45.063 -195.782 A 183 GLY A 146 GLY.? B 419 GLY A 148 GLY.? B 420 ALA A 115 ALA~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 7 3 RMSD = 1.06 A TRANSFORM -0.9908 -0.0519 -0.1253 0.1287 -0.0677 -0.9894 0.0429 -0.9964 0.0738 48.282 -65.114 -69.274 A 420 ALA A 147 ALA.? B 182 GLY A 175 GLY.? B 183 GLY A 174 GLY.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.09 A TRANSFORM -0.6663 0.4498 0.5947 -0.1081 -0.8474 0.5198 0.7378 0.2821 0.6132 -22.041 -24.759 -164.600 A 183 GLY A 118 GLY.? B 419 GLY A 146 GLY.? B 420 ALA A 147 ALA.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 RMSD = 1.16 A TRANSFORM -0.9128 0.0956 -0.3970 0.3588 0.6520 -0.6680 0.1950 -0.7522 -0.6294 44.331 -126.889 -58.566 A 420 ALA A 115 ALA~? B 182 GLY A 118 GLY.? B 183 GLY A 146 GLY.? ULMNm 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 RMSD = 1.19 A TRANSFORM -0.6682 0.1998 0.7166 0.7112 0.4543 0.5365 -0.2184 0.8681 -0.4457 -44.565 0.865 -61.191 A 81 ASP A 206 ASP.? A 99 GLY A 118 GLY.? A 125 ASN A 144 ASN^? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 1.20 A TRANSFORM 0.2835 -0.2488 -0.9261 0.5473 0.8350 -0.0568 0.7875 -0.4908 0.3729 20.453 48.214 132.079 D 137 ARG A 213 ARG^? D 141 THR A 124 THR.? D 235 ASP A 79 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.20 A TRANSFORM 0.9206 -0.2222 0.3210 -0.3235 0.0262 0.9459 -0.2186 -0.9746 -0.0478 46.151 -130.919 -60.673 A 420 ALA A 114 ALA~? B 182 GLY A 146 GLY.? B 183 GLY A 118 GLY.? ULMNm 3 2dbt_c02 CHITINASE C user 1 3 RMSD = 1.20 A TRANSFORM 0.7936 -0.5866 -0.1618 0.5592 0.8079 -0.1860 0.2399 0.0571 0.9691 105.014 -17.970 20.575 C 147 GLU A 62 GLU^? C 156 GLU A 59 GLU.? C 194 ASN A 7 ASN.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.27 A TRANSFORM 0.6248 -0.5557 0.5485 0.7756 0.5229 -0.3536 -0.0903 0.6463 0.7577 27.575 -1.800 -56.140 141 ASP A 167 ASP.? 166 GLY A 76 GLY^? 169 GLU A 80 GLU^? ULMNm 3 2dbt_c01 CHITINASE C user 2 3 RMSD = 1.28 A TRANSFORM 0.2881 -0.5992 -0.7470 -0.6272 -0.7075 0.3256 -0.7236 0.3748 -0.5796 94.032 101.976 -33.150 B 147 GLU A 62 GLU^? B 156 GLU A 59 GLU.? B 194 ASN A 7 ASN.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 1.29 A TRANSFORM 0.7538 -0.3038 -0.5827 0.6457 0.1774 0.7427 -0.1223 -0.9361 0.3299 78.737 -136.878 -74.270 A 420 ALA A 114 ALA~? B 182 GLY A 146 GLY.? B 183 GLY A 148 GLY.? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 1.29 A TRANSFORM -0.7936 0.5541 0.2514 -0.6063 -0.6855 -0.4030 -0.0510 -0.4722 0.8800 -38.718 109.086 69.164 C 603 HIS A 153 HIS^? C 646 ASP A 107 ASP.? C 739 GLY A 148 GLY.? ULMNm 3 2dbt_c00 CHITINASE C user 2 3 RMSD = 1.30 A TRANSFORM -0.5904 0.6251 0.5107 -0.4489 -0.7801 0.4359 0.6708 0.0281 0.7411 14.758 65.336 27.979 A 147 GLU A 62 GLU^? A 156 GLU A 59 GLU.? A 194 ASN A 7 ASN.? ULMNm 3 1ecf_c00 GLUTAMINE PHOSPHORIBOSYLPYROPHOSPHATuser 1 3 RMSD = 1.31 A TRANSFORM -0.6604 0.6627 0.3531 0.4994 0.0365 0.8656 0.5607 0.7480 -0.3551 13.583 39.172 5.394 A 1 CYH A 204 CYH^? A 101 ASN A 205 ASN.? A 102 GLY A 118 GLY.? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.31 A TRANSFORM -0.8275 0.5215 0.2080 -0.5598 -0.7379 -0.3770 -0.0431 -0.4284 0.9026 -33.158 113.430 2.438 A 603 HIS A 153 HIS^? A 646 ASP A 107 ASP.? A 739 GLY A 148 GLY.? ULMNm 3 1ecf_c01 GLUTAMINE PHOSPHORIBOSYLPYROPHOSPHATuser 1 3 RMSD = 1.31 A TRANSFORM 0.5119 0.7974 -0.3197 -0.4942 -0.0310 -0.8688 -0.7027 0.6027 0.3782 33.778 39.227 -16.602 B 1 CYH A 204 CYH^? B 101 ASN A 205 ASN.? B 102 GLY A 118 GLY.? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 RMSD = 1.32 A TRANSFORM -0.0317 0.6737 -0.7383 0.1573 -0.7262 -0.6693 -0.9871 -0.1373 -0.0830 -30.341 123.861 97.431 A 270 ASN A 64 ASN^? A 384 ASN A 108 ASN~? A 385 GLU A 18 GLU.? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.35 A TRANSFORM 0.4667 0.3564 -0.8094 0.8787 -0.2903 0.3789 -0.0999 -0.8881 -0.4486 -28.514 54.394 113.816 D 603 HIS A 153 HIS^? D 646 ASP A 107 ASP.? D 739 GLY A 146 GLY.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 RMSD = 1.38 A TRANSFORM -0.8159 0.2737 -0.5094 -0.5556 -0.6149 0.5596 -0.1601 0.7396 0.6538 36.543 34.310 -45.179 A 67 ASP A 206 ASP.? A 68 ALA A 209 ALA.? A 72 LEU A 211 LEU^? ULMNm 3 1jxa_c02 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.39 A TRANSFORM 0.5394 -0.0425 -0.8410 -0.3550 -0.9171 -0.1814 -0.7636 0.3964 -0.5097 -2.103 67.826 -22.409 A 1 CYH A 204 CYH^? A 98 ASN A 205 ASN.? A 99 GLY A 118 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.41 A TRANSFORM -0.0098 -0.1715 -0.9851 0.9393 -0.3396 0.0497 -0.3431 -0.9248 0.1644 81.068 -78.080 -70.132 A 420 ALA A 114 ALA~? B 182 GLY A 118 GLY.? B 183 GLY A 148 GLY.? ULMNm 3 1oqz_c00 GLUTARYL ACYLASE user 2 3 RMSD = 1.42 A TRANSFORM -0.3830 -0.7980 -0.4652 0.6652 -0.5877 0.4605 -0.6410 -0.1331 0.7559 119.346 97.311 47.736 A 170 SER A 6 SER.? A 239 VAL A 26 VAL^? A 413 ASN A 28 ASN^? ULMNm 3 1myr_c00 MYROSINASE user 1 3 RMSD = 1.43 A TRANSFORM 0.5089 -0.7503 -0.4220 -0.3888 0.2370 -0.8903 0.7680 0.6172 -0.1711 102.617 81.326 34.422 187 GLN A 4 GLN^? 328 ASN A 28 ASN^? 409 GLU A 59 GLU.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.45 A TRANSFORM -0.9100 0.1188 -0.3973 0.4111 0.1324 -0.9019 -0.0545 -0.9840 -0.1694 42.740 -85.151 -56.503 A 420 ALA A 114 ALA~? B 182 GLY A 118 GLY.? B 183 GLY A 146 GLY.? ULMNm 3 3qwd_o03 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.45 A TRANSFORM 0.8825 0.3959 -0.2539 0.4527 -0.5686 0.6869 0.1276 -0.7211 -0.6810 57.783 114.769 89.155 D 98 SER A 154 SER^? D 123 HIS A 153 HIS^? D 172 ASP A 107 ASP.? ULMNm 3 1jxa_c03 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.45 A TRANSFORM -0.1443 0.9284 -0.3424 0.2145 0.3671 0.9051 0.9660 0.0571 -0.2521 -47.951 16.667 43.790 B 1 CYH A 204 CYH^? B 98 ASN A 205 ASN.? B 99 GLY A 118 GLY.? ULMNm 3 3qwd_o05 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.45 A TRANSFORM -0.5940 0.3050 -0.7444 0.8043 0.2419 -0.5427 0.0146 -0.9211 -0.3890 5.914 77.325 97.778 F 98 SER A 154 SER^? F 123 HIS A 153 HIS^? F 172 ASP A 107 ASP.? ULMNm 3 3qwd_o11 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.45 A TRANSFORM -0.7406 -0.4863 0.4637 -0.5663 0.0803 -0.8203 0.3617 -0.8701 -0.3348 137.249 7.344 158.916 L 98 SER A 154 SER^? L 123 HIS A 153 HIS^? L 172 ASP A 107 ASP.? ULMNm 3 3qwd_o09 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.45 A TRANSFORM -0.4332 0.3726 -0.8207 0.9013 0.1825 -0.3928 0.0034 -0.9099 -0.4149 94.513 56.985 146.960 J 98 SER A 154 SER^? J 123 HIS A 153 HIS^? J 172 ASP A 107 ASP.? ULMNm 3 3qwd_o04 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.46 A TRANSFORM 0.2660 0.5572 -0.7866 0.9637 -0.1722 0.2039 -0.0218 -0.8124 -0.5828 22.381 109.302 89.671 E 98 SER A 154 SER^? E 123 HIS A 153 HIS^? E 172 ASP A 107 ASP.? ULMNm 3 1gdo_c02 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.46 A TRANSFORM 0.3746 0.3935 -0.8396 -0.0514 0.9129 0.4049 0.9258 -0.1085 0.3622 6.932 -77.404 49.004 A 1 CYH A 204 CYH^? A 98 ASN A 205 ASN.? A 99 GLY A 118 GLY.? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 RMSD = 1.46 A TRANSFORM 0.6205 -0.7840 0.0181 -0.6070 -0.4948 -0.6218 0.4965 0.3749 -0.7829 44.792 34.057 -19.838 A 49 ASP A 184 ASP~? A 147 THR A 135 THR.? A 294 ASP A 132 ASP.? ULMNm 3 3qwd_o06 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.46 A TRANSFORM -0.9774 -0.1680 -0.1285 0.0782 0.2776 -0.9575 0.1966 -0.9459 -0.2581 21.482 46.764 106.138 G 98 SER A 154 SER^? G 123 HIS A 153 HIS^? G 172 ASP A 107 ASP.? ULMNm 3 3qwd_o01 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.46 A TRANSFORM 0.2044 -0.4573 0.8655 -0.8766 -0.4790 -0.0460 0.4356 -0.7493 -0.4988 85.372 57.877 103.617 B 98 SER A 154 SER^? B 123 HIS A 153 HIS^? B 172 ASP A 107 ASP.? ULMNm 3 3qwd_o07 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.46 A TRANSFORM 0.9463 0.2991 -0.1224 0.2939 -0.6389 0.7110 0.1344 -0.7088 -0.6925 153.092 85.810 139.029 H 98 SER A 154 SER^? H 123 HIS A 153 HIS^? H 172 ASP A 107 ASP.? ULMNm 3 3qwd_o02 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.46 A TRANSFORM 0.8704 -0.0618 0.4885 -0.3706 -0.7354 0.5672 0.3242 -0.6748 -0.6630 86.110 93.875 94.578 C 98 SER A 154 SER^? C 123 HIS A 153 HIS^? C 172 ASP A 107 ASP.? ULMNm 3 3qwd_o08 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.46 A TRANSFORM 0.3995 0.5293 -0.7485 0.9163 -0.2564 0.3078 -0.0290 -0.8088 -0.5874 117.198 85.746 139.358 I 98 SER A 154 SER^? I 123 HIS A 153 HIS^? I 172 ASP A 107 ASP.? ULMNm 3 3qwd_o13 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.46 A TRANSFORM 0.7869 -0.1954 0.5853 -0.5283 -0.7036 0.4753 0.3189 -0.6832 -0.6569 178.076 58.711 145.301 N 98 SER A 154 SER^? N 123 HIS A 153 HIS^? N 172 ASP A 107 ASP.? ULMNm 3 3qwd_o12 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.46 A TRANSFORM 0.0479 -0.5382 0.8415 -0.8972 -0.3935 -0.2006 0.4391 -0.7453 -0.5017 171.003 24.364 153.909 M 98 SER A 154 SER^? M 123 HIS A 153 HIS^? M 172 ASP A 107 ASP.? ULMNm 3 1gdo_c03 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.46 A TRANSFORM -0.3798 -0.4018 0.8332 0.0490 -0.9082 -0.4156 0.9237 -0.1171 0.3647 28.978 84.120 92.545 C 1 CYH A 204 CYH^? C 98 ASN A 205 ASN.? C 99 GLY A 118 GLY.? ULMNm 3 3qwd_o10 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.47 A TRANSFORM -0.9490 -0.1059 -0.2971 0.2511 0.3164 -0.9148 0.1909 -0.9427 -0.2736 105.091 23.364 155.746 K 98 SER A 154 SER^? K 123 HIS A 153 HIS^? K 172 ASP A 107 ASP.? ULMNm 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 1 3 RMSD = 1.48 A TRANSFORM -0.9392 0.1859 -0.2889 0.1250 0.9682 0.2166 0.3199 0.1673 -0.9325 -34.410 -5.475 39.934 A 104 ILE A 203 ILE^? A 106 HIS A 153 HIS^? A 142 ASP A 107 ASP.? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.48 A TRANSFORM -0.5821 -0.5343 0.6130 -0.7252 0.0002 -0.6885 0.3678 -0.8453 -0.3876 58.487 33.890 108.461 A 98 SER A 154 SER^? A 123 HIS A 153 HIS^? A 172 ASP A 107 ASP.? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.48 A TRANSFORM -0.5821 -0.5343 0.6130 -0.7252 0.0002 -0.6885 0.3678 -0.8453 -0.3876 58.487 33.890 108.461 A 98 SER A 154 SER^? A 123 HIS A 153 HIS^? A 172 ASP A 107 ASP.? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.48 A TRANSFORM -0.6022 0.5743 0.5546 -0.7799 -0.5715 -0.2552 0.1704 -0.5862 0.7921 -45.011 95.991 81.396 C 603 HIS A 153 HIS^? C 646 ASP A 107 ASP.? C 739 GLY A 146 GLY.? ULMNm 3 1gdo_c00 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.49 A TRANSFORM -0.3645 -0.3599 0.8588 0.0325 -0.9266 -0.3746 0.9306 -0.1086 0.3495 60.880 123.383 92.469 B 1 CYH A 204 CYH^? B 98 ASN A 205 ASN.? B 99 GLY A 118 GLY.?