4. HEADER ACYLTRANSFERASE 07-OCT-95 1LXA TITLE UDP N-ACETYLGLUCOSAMINE ACYLTRANSFERASE COMPND MOL_ID: 1; COMPND 2 MOLECULE: UDP N-ACETYLGLUCOSAMINE O-ACYLTRANSFERASE; COMPND 3 CHAIN: NULL; COMPND 4 SYNONYM: LPXA; COMPND 5 EC: 2.3.1.129; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: S64Q, V65F, D125H SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 STRAIN: K12; SOURCE 4 EXPRESSION_SYSTEM: MC1061; SOURCE 5 EXPRESSION_SYSTEM_PLASMID: PSR1; SOURCE 6 EXPRESSION_SYSTEM_GENE: LPXA KEYWDS 2 LIPID SYNTHESIS EXPDTA XRAY DIFFRACTION - SINGLE CRYSTAL AUTHOR S.L.RODERICK REMARK 2 REMARK 2 RESOLUTION. 2.6 ANGSTROMS. REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP:P213 REMARK 290 CRYST1 99.000 99.000 99.000 90.00 90.00 90.00 P 1 1 SCALE1 0.010101 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010101 0.000000 0.00000 SCALE3 0.000000 0.000000 0.010101 0.00000 ATOM 1 N MET A 1 88.077 94.618 63.411 1.00 77.61 ATOM 2 CA MET A 1 87.915 95.650 64.419 1.00 75.36 ATOM 3 C MET A 1 86.517 95.664 65.029 1.00 59.38 ATOM 4 O MET A 1 85.616 95.027 64.492 1.00 60.53 ATOM 5 CB MET A 1 88.320 97.030 63.876 1.00 81.46 ATOM 6 CG MET A 1 88.928 97.940 64.937 1.00 90.73 ATOM 7 SD MET A 1 88.279 99.634 64.871 1.00100.00 ATOM 8 CE MET A 1 87.314 99.554 63.336 1.00 96.83 ATOM 9 N ILE A 2 86.335 96.385 66.151 1.00 38.83 ATOM 10 CA ILE A 2 85.048 96.441 66.828 1.00 33.63 ATOM 11 C ILE A 2 84.476 97.800 67.176 1.00 40.90 ATOM 12 O ILE A 2 85.112 98.600 67.855 1.00 41.85 ATOM 13 CB ILE A 2 85.132 95.721 68.140 1.00 35.31 ATOM 14 CG1 ILE A 2 85.453 94.275 67.899 1.00 37.35 ATOM 15 CG2 ILE A 2 83.799 95.853 68.856 1.00 32.19 ATOM 16 CD1 ILE A 2 85.370 93.526 69.210 1.00 53.60 ATOM 17 N ASP A 3 83.226 97.987 66.777 1.00 41.11 ATOM 18 CA ASP A 3 82.469 99.207 67.004 1.00 42.45 ATOM 19 C ASP A 3 82.283 99.669 68.426 1.00 42.41 Archivo de coordenadas Formato PDB
28. Comparación de la estructura de proteínas Cambios conformacionales (ligandos, inhibidores) Detección de relaciones evolutivas lejanas Variación estructural en una familia por adaptación funcional Identificación de estructuras nativas comunes. Super plegamientos
49. http://scop.mrc-lmb.cam.ac.uk/scop/ 2845 1539 945 Total 171 108 75 Small proteins 99 88 47 Membrane and cell surface proteins 61 46 46 Multi-domain proteins 717 409 279 Alpha and beta proteins (a+b) 629 222 136 Alpha and beta proteins (a/b) 560 290 144 All beta proteins 608 376 218 All alpha proteins Number of families Number of superfamilies Number of folds Class