*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ TRANSFORM -0.1977 -0.9320 0.3039 -0.0948 0.3268 0.9403 0.9757 -0.1571 0.1529 2.568 13.411 -22.525 Match found in 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOM Pattern 1bmt_c05 Query structure RMSD= 0.98 A No. of residues = 3 ------- ------- --------------- B 757 ASP matches A 30 ASP B 759 HIS matches B 0 HIS B 810 SER matches A 28 SER TRANSFORM -0.7759 0.4271 -0.4643 0.4704 -0.0988 -0.8769 0.4204 0.8988 0.1242 65.468 95.491 -2.267 Match found in 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOM Pattern 1bmt_c04 Query structure RMSD= 1.00 A No. of residues = 3 ------- ------- --------------- A 757 ASP matches A 30 ASP A 759 HIS matches B 0 HIS A 810 SER matches A 28 SER TRANSFORM 0.1593 0.9770 -0.1416 -0.9861 0.1505 -0.0709 0.0480 -0.1509 -0.9874 -23.583 101.492 70.408 Match found in 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOM Pattern 1bmt_c05 Query structure RMSD= 1.01 A No. of residues = 3 ------- ------- --------------- B 757 ASP matches B 30 ASP B 759 HIS matches A 0 HIS B 810 SER matches B 28 SER TRANSFORM 0.1179 -0.2745 0.9543 0.8631 -0.4469 -0.2351 -0.4910 -0.8514 -0.1842 -27.414 54.708 80.131 Match found in 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOM Pattern 1bmt_c04 Query structure RMSD= 1.02 A No. of residues = 3 ------- ------- --------------- A 757 ASP matches B 30 ASP A 759 HIS matches A 0 HIS A 810 SER matches B 28 SER TRANSFORM -0.4386 0.7211 -0.5363 -0.7995 -0.0407 0.5992 -0.4103 -0.6916 -0.5944 76.482 19.469 51.597 Match found in 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE Pattern 1eo7_c00 Query structure RMSD= 1.16 A No. of residues = 3 ------- ------- --------------- A 229 ALA matches B 90 ALA A 257 ALA matches B 3 ALA A 328 ASP matches A 58 ASP TRANSFORM -0.1392 0.9882 0.0643 -0.3606 0.0099 -0.9327 0.9223 0.1531 -0.3550 -14.386 71.517 -31.313 Match found in 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE Pattern 1qgx_c02 Query structure RMSD= 1.22 A No. of residues = 3 ------- ------- --------------- A 49 ASP matches A 30 ASP A 147 THR matches A 32 THR A 294 ASP matches B 68 ASP TRANSFORM -0.4716 -0.7760 0.4188 0.7955 -0.1694 0.5818 0.3805 -0.6075 -0.6972 12.215 -46.350 20.512 Match found in 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE Pattern 1qgx_c02 Query structure RMSD= 1.26 A No. of residues = 3 ------- ------- --------------- A 49 ASP matches B 30 ASP A 147 THR matches B 32 THR A 294 ASP matches A 68 ASP TRANSFORM -0.7183 0.4088 0.5629 -0.6952 -0.4538 -0.5575 -0.0275 0.7918 -0.6102 35.904 50.243 62.358 Match found in 1ybv_c01 TRIHYDROXYNAPHTHALENE REDUCTASE Pattern 1ybv_c01 Query structure RMSD= 1.32 A No. of residues = 3 ------- ------- --------------- B 164 SER matches B 39 SER B 178 TYR matches B 48 TYR B 182 LYS matches B 46 LYS TRANSFORM 0.7163 -0.4158 -0.5603 -0.3984 0.4154 -0.8177 -0.5728 -0.8090 -0.1319 106.721 59.384 45.460 Match found in 1ybv_c00 TRIHYDROXYNAPHTHALENE REDUCTASE Pattern 1ybv_c00 Query structure RMSD= 1.33 A No. of residues = 3 ------- ------- --------------- A 164 SER matches B 39 SER A 178 TYR matches B 48 TYR A 182 LYS matches B 46 LYS TRANSFORM -0.0610 -0.0097 -0.9981 0.3978 0.9169 -0.0332 -0.9155 0.3990 0.0521 49.016 20.696 105.670 Match found in 1eq2_c02 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c02 Query structure RMSD= 1.33 A No. of residues = 3 ------- ------- --------------- C 116 SER matches B 39 SER C 140 TYR matches B 48 TYR C 144 LYS matches B 46 LYS TRANSFORM -0.8896 0.3862 -0.2438 0.3872 0.9209 0.0459 -0.2423 0.0536 0.9687 54.442 18.270 37.321 Match found in 1eq2_c01 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c01 Query structure RMSD= 1.34 A No. of residues = 3 ------- ------- --------------- B 116 SER matches B 39 SER B 140 TYR matches B 48 TYR B 144 LYS matches B 46 LYS TRANSFORM 0.5395 -0.1521 -0.8281 -0.3757 -0.9237 -0.0751 0.7535 -0.3516 0.5555 52.444 109.714 -32.471 Match found in 1eq2_c08 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c08 Query structure RMSD= 1.34 A No. of residues = 3 ------- ------- --------------- I 116 SER matches B 39 SER I 140 TYR matches B 48 TYR I 144 LYS matches B 46 LYS TRANSFORM 0.4369 0.1239 -0.8909 -0.6087 0.7700 -0.1914 -0.6623 -0.6259 -0.4119 88.492 39.939 69.395 Match found in 1uok_c04 OLIGO-1,6-GLUCOSIDASE Pattern 1uok_c04 Query structure RMSD= 1.34 A No. of residues = 3 ------- ------- --------------- 199 ASP matches A 33 ASP 218 GLU matches A 16 GLU 329 ASP matches B 68 ASP TRANSFORM 0.3177 -0.9341 0.1631 0.4524 0.3005 0.8397 0.8333 0.1930 -0.5180 20.264 -55.820 -6.279 Match found in 3b21_o00 SHIGELLA FLEXNERI EFFECTOR OSPI Pattern 3b21_o00 Query structure RMSD= 1.34 A No. of residues = 3 ------- ------- --------------- A 62 CYH matches A 49 CYH A 145 HIS matches A 0 HIS A 160 ASP matches B 30 ASP TRANSFORM -0.4520 0.5830 -0.6751 0.4094 0.8080 0.4237 -0.7925 0.0849 0.6039 71.837 14.182 25.957 Match found in 1gz6_c00 ESTRADIOL 17 BETA-DEHYDROGENASE 4 Pattern 1gz6_c00 Query structure RMSD= 1.34 A No. of residues = 3 ------- ------- --------------- A 151 SER matches B 39 SER A 164 TYR matches B 48 TYR A 168 LYS matches B 46 LYS TRANSFORM 0.0468 -0.0036 0.9989 -0.3740 -0.9273 0.0142 -0.9262 0.3742 0.0448 -2.397 106.291 64.412 Match found in 1eq2_c05 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c05 Query structure RMSD= 1.34 A No. of residues = 3 ------- ------- --------------- F 116 SER matches B 39 SER F 140 TYR matches B 48 TYR F 144 LYS matches B 46 LYS TRANSFORM 0.8137 -0.4590 -0.3568 0.4838 0.8749 -0.0222 -0.3223 0.1546 -0.9339 -17.219 16.807 120.210 Match found in 1eq2_c03 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c03 Query structure RMSD= 1.34 A No. of residues = 3 ------- ------- --------------- D 116 SER matches B 39 SER D 140 TYR matches B 48 TYR D 144 LYS matches B 46 LYS TRANSFORM -0.5182 0.3886 -0.7619 -0.4942 -0.8631 -0.1041 0.6980 -0.3226 -0.6393 97.005 115.735 20.023 Match found in 1eq2_c09 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c09 Query structure RMSD= 1.35 A No. of residues = 3 ------- ------- --------------- J 116 SER matches B 39 SER J 140 TYR matches B 48 TYR J 144 LYS matches B 46 LYS TRANSFORM 0.5308 -0.3842 0.7554 0.5019 0.8607 0.0852 0.6829 -0.3339 -0.6497 -50.424 11.953 62.824 Match found in 1eq2_c04 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c04 Query structure RMSD= 1.35 A No. of residues = 3 ------- ------- --------------- E 116 SER matches B 39 SER E 140 TYR matches B 48 TYR E 144 LYS matches B 46 LYS TRANSFORM -0.8084 0.4651 0.3608 -0.4796 -0.8758 0.0544 -0.3413 0.1291 -0.9310 63.288 108.231 78.608 Match found in 1eq2_c06 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c06 Query structure RMSD= 1.35 A No. of residues = 3 ------- ------- --------------- G 116 SER matches B 39 SER G 140 TYR matches B 48 TYR G 144 LYS matches B 46 LYS TRANSFORM -0.5254 0.1538 0.8368 0.3936 0.9159 0.0789 0.7543 -0.3709 0.5418 -6.792 16.485 10.149 Match found in 1eq2_c00 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c00 Query structure RMSD= 1.35 A No. of residues = 3 ------- ------- --------------- A 116 SER matches B 39 SER A 140 TYR matches B 48 TYR A 144 LYS matches B 46 LYS TRANSFORM -0.5696 0.5865 -0.5758 -0.4065 -0.8099 -0.4228 0.7144 0.0068 -0.6997 64.690 71.038 121.671 Match found in 1gz6_c03 ESTRADIOL 17 BETA-DEHYDROGENASE 4 Pattern 1gz6_c03 Query structure RMSD= 1.36 A No. of residues = 3 ------- ------- --------------- D 151 SER matches B 39 SER D 164 TYR matches B 48 TYR D 168 LYS matches B 46 LYS TRANSFORM 0.8937 -0.3707 0.2528 -0.3708 -0.9274 -0.0493 -0.2527 0.0497 0.9663 -8.807 108.008 -4.173 Match found in 1eq2_c07 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIME Pattern 1eq2_c07 Query structure RMSD= 1.36 A No. of residues = 3 ------- ------- --------------- H 116 SER matches B 39 SER H 140 TYR matches B 48 TYR H 144 LYS matches B 46 LYS TRANSFORM 0.3317 -0.8976 0.2905 0.6207 -0.0242 -0.7836 -0.7104 -0.4402 -0.5491 39.756 70.034 80.315 Match found in 1uok_c05 OLIGO-1,6-GLUCOSIDASE Pattern 1uok_c05 Query structure RMSD= 1.39 A No. of residues = 3 ------- ------- --------------- 199 ASP matches B 33 ASP 242 GLU matches A 45 GLU 329 ASP matches A 68 ASP TRANSFORM 0.2599 0.7095 -0.6551 -0.8708 -0.1209 -0.4765 0.4173 -0.6943 -0.5864 34.213 68.565 27.960 Match found in 3b21_o00 SHIGELLA FLEXNERI EFFECTOR OSPI Pattern 3b21_o00 Query structure RMSD= 1.40 A No. of residues = 3 ------- ------- --------------- A 62 CYH matches B 49 CYH A 145 HIS matches B 0 HIS A 160 ASP matches A 30 ASP TRANSFORM 0.1155 -0.5619 -0.8191 0.0544 -0.8198 0.5701 0.9918 0.1104 0.0641 63.143 -1.936 0.488 Match found in 2odj_o00 PORIN D Pattern 2odj_o00 Query structure RMSD= 1.40 A No. of residues = 3 ------- ------- --------------- A 156 HIS matches B 0 HIS A 208 ASP matches A 58 ASP A 296 SER matches B 29 SER TRANSFORM 0.9618 0.2625 -0.0775 -0.1604 0.3114 -0.9366 0.2218 -0.9133 -0.3417 3.176 169.923 35.256 Match found in 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLA Pattern 2amg_c02 Query structure RMSD= 1.41 A No. of residues = 3 ------- ------- --------------- 193 ASP matches A 63 ASP 219 GLU matches A 64 GLU 294 ASP matches A 68 ASP TRANSFORM 0.0243 -0.4726 0.8810 -0.9127 0.3491 0.2125 0.4079 0.8092 0.4228 19.039 36.535 -38.974 Match found in 1uok_c04 OLIGO-1,6-GLUCOSIDASE Pattern 1uok_c04 Query structure RMSD= 1.45 A No. of residues = 3 ------- ------- --------------- 199 ASP matches B 68 ASP 218 GLU matches B 79 GLU 329 ASP matches A 33 ASP TRANSFORM -0.0926 -0.3004 0.9493 -0.6958 -0.6624 -0.2775 -0.7122 0.6862 0.1477 -36.553 83.670 52.213 Match found in 1gz6_c01 ESTRADIOL 17 BETA-DEHYDROGENASE 4 Pattern 1gz6_c01 Query structure RMSD= 1.46 A No. of residues = 3 ------- ------- --------------- B 151 SER matches B 39 SER B 164 TYR matches B 48 TYR B 168 LYS matches B 46 LYS TRANSFORM -0.9605 -0.0042 0.2782 0.2571 0.3691 0.8931 0.1064 -0.9294 0.3535 -35.105 -99.570 -8.641 Match found in 1cwy_c00 AMYLOMALTASE Pattern 1cwy_c00 Query structure RMSD= 1.46 A No. of residues = 3 ------- ------- --------------- A 293 ASP matches A 68 ASP A 340 GLU matches A 64 GLU A 395 ASP matches B 33 ASP TRANSFORM 0.1503 -0.6437 -0.7504 0.6936 -0.4722 0.5440 0.7045 0.6023 -0.3755 85.729 75.686 -8.821 Match found in 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLA Pattern 2amg_c02 Query structure RMSD= 1.46 A No. of residues = 3 ------- ------- --------------- 193 ASP matches B 63 ASP 219 GLU matches B 64 GLU 294 ASP matches B 68 ASP TRANSFORM -0.2970 -0.9315 -0.2101 -0.7640 0.3638 -0.5330 -0.5729 -0.0022 0.8197 86.941 128.922 5.991 Match found in 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E. Pattern 1cdg_c04 Query structure RMSD= 1.48 A No. of residues = 3 ------- ------- --------------- 229 ASP matches B 33 ASP 257 GLU matches A 52 GLU 328 ASP matches A 33 ASP TRANSFORM 0.5394 0.8419 0.0160 0.2525 -0.1798 0.9507 -0.8033 0.5088 0.3096 11.947 24.460 31.568 Match found in 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E. Pattern 1cdg_c04 Query structure RMSD= 1.48 A No. of residues = 3 ------- ------- --------------- 229 ASP matches A 33 ASP 257 GLU matches B 52 GLU 328 ASP matches B 33 ASP TRANSFORM -0.2082 -0.1842 0.9606 0.6943 0.6639 0.2778 0.6889 -0.7248 0.0104 -38.436 1.637 78.534 Match found in 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 Pattern 1gz6_c02 Query structure RMSD= 1.48 A No. of residues = 3 ------- ------- --------------- C 151 SER matches B 39 SER C 164 TYR matches B 48 TYR C 168 LYS matches B 46 LYS