ID 1RHQA STANDARD; PRT; 147 AA. DT CONVERTED FROM PDB (SEQRES) 1RHQ DE Caspase-3 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.273 FT #SUB 6 150 ASP A 96 396 LYS B Protein B 4 FT #SUB 7 151 ASN A 96 396 LYS B Protein B 4 FT #SUB 7 151 ASN A 97 397 GLU B Protein A 7 FT #SUB 8 152 SER A 96 396 LYS B Protein B 2 FT #SUB 8 152 SER A 97 397 GLU B Protein A 6 FT #SUB 9 153 TYR A 17 326 ASP B Protein S 6 FT #SUB 9 153 TYR A 94 394 LEU B Protein S 6 FT #SUB 9 153 TYR A 95 395 THR B Protein S 3 FT #SUB 9 153 TYR A 96 396 LYS B Protein A 14 FT #SUB 9 153 TYR A 97 397 GLU B Protein A 7 FT #SUB 11 155 MET A 98 398 LEU B Protein S 3 FT #SUB 11 155 MET A 101 401 TYR B Protein B 1 FT #SUB 16 162A MET A 100 400 PHE B Protein S 2 FT #SUB 16 162A MET A 101 401 TYR B Protein S 1 FT #SUB 36 179 ARG A 32 341 ARG B Protein A 6 FT #SUB 36 179 ARG A 38 347 SER B Protein S 1 FT #SUB 37 180 SER A 33 342 ASN B Protein B 2 FT #SUB 37 180 SER A 34 343 SER B Protein A 6 FT #SUB 41 184 VAL A 35 344 LYS B Protein S 1 FT #SUB 41 184 VAL A 36 345 ASP B Protein S 6 FT #SUB 42 185 ASP A 37 346 GLY B Protein S 4 FT #SUB 42 185 ASP A 38 347 SER B Protein S 9 FT #SUB 42 185 ASP A 41 350 ILE B Protein S 5 FT #SUB 45 188 ASN A 45 354 CYS B Protein S 2 FT #SUB 46 189 LEU A 41 350 ILE B Protein S 2 FT #SUB 46 189 LEU A 45 354 CYS B Protein A 2 FT #SUB 49 192 THR A 45 354 CYS B Protein S 5 FT #SUB 49 192 THR A 48 357 LEU B Protein S 2 FT #SUB 49 192 THR A 49 358 LYS B Protein S 1 FT #SUB 55 198 TYR A 100 400 PHE B Protein S 2 FT #SUB 96 240 GLU A 26 335 PRO B Protein S 3 FT #SUB 96 240 GLU A 27 336 GLY B Protein S 1 FT #SUB 108 258 LEU A 22 331 TYR B Protein S 1 FT #SUB 109 259 LYS A 15 324 GLU B Protein S 2 FT #SUB 112 262 THR A 18 327 PHE B Protein A 3 FT #SUB 116 266 ARG A 14 323 VAL B Protein A 7 FT #SUB 116 266 ARG A 15 324 GLU B Protein S 3 FT #SUB 116 266 ARG A 18 327 PHE B Protein B 1 FT #SUB 117 267 GLY A 14 323 VAL B Protein B 8 FT #SUB 118 268 ASP A 14 323 VAL B Protein A 3 FT #SUB 125 275 GLY A 17 326 ASP B Protein B 3 FT #SUB 126 276 LYS A 17 326 ASP B Protein B 3 FT #SUB 127 277 PRO A 17 326 ASP B Protein B 2 FT #SUB 127 277 PRO A 98 398 LEU B Protein S 2 FT #SUB 128 278 LYS A 16 325 ALA B Protein S 1 FT #SUB 128 278 LYS A 17 326 ASP B Protein A 5 FT #SUB 128 278 LYS A 18 327 PHE B Protein A 5 FT #SUB 128 278 LYS A 19 328 LEU B Protein B 4 FT #SUB 129 279 LEU A 19 328 LEU B Protein A 4 FT #SUB 130 280 PHE A 19 328 LEU B Protein A 4 FT #SUB 130 280 PHE A 20 329 TYR B Protein B 1 FT #SUB 130 280 PHE A 21 330 ALA B Protein B 1 FT #SUB 131 281 ILE A 21 330 ALA B Protein A 2 FT #SUB 131 281 ILE A 40 349 PHE B Protein S 1 FT #SUB 132 282 ILE A 21 330 ALA B Protein B 2 FT #SUB 132 282 ILE A 22 331 TYR B Protein A 4 FT #SUB 132 282 ILE A 23 332 SER B Protein B 3 FT #SUB 133 283 GLN A 23 332 SER B Protein A 6 FT #SUB 133 283 GLN A 30 339 SER B Protein S 1 FT #SUB 133 283 GLN A 38 347 SER B Protein S 8 FT #SUB 133 283 GLN A 40 349 PHE B Protein S 2 FT #SUB 133 283 GLN A 41 350 ILE B Protein S 5 FT #SUB 134 284 ALA A 23 332 SER B Protein B 2 FT #SUB 134 284 ALA A 24 333 THR B Protein B 1 FT #SUB 134 284 ALA A 30 339 SER B Protein B 4 FT #SUB 135 285 CYS A 29 338 TYR B Protein S 1 FT #SUB 135 285 CYS A 30 339 SER B Protein A 2 FT #SUB 136 286 ARG A 22 331 TYR B Protein S 14 FT #SUB 136 286 ARG A 24 333 THR B Protein S 6 FT #SUB 136 286 ARG A 25 334 ALA B Protein S 3 FT #SUB 136 286 ARG A 26 335 PRO B Protein A 10 FT #SUB 136 286 ARG A 27 336 GLY B Protein A 8 FT #SUB 136 286 ARG A 28 337 TYR B Protein A 6 FT #SUB 136 286 ARG A 89 388 CYS B Protein S 2 FT #SUB 137 287 GLY A 27 336 GLY B Protein B 4 FT #SUB 137 287 GLY A 28 337 TYR B Protein B 4 FT #SUB 137 287 GLY A 29 338 TYR B Protein B 1 FT #SUB 138 288 THR A 27 336 GLY B Protein B 4 FT #SUB 138 288 THR A 29 338 TYR B Protein A 11 FT #SUB 139 289 GLU A 27 336 GLY B Protein A 5 FT #SUB 139 289 GLU A 28 337 TYR B Protein A 6 FT #SUB 139 289 GLU A 29 338 TYR B Protein B 4 FT #SUB 140 290 LEU A 28 337 TYR B Protein B 2 FT #SUB 140 290 LEU A 29 338 TYR B Protein S 2 FT #SUB 140 290 LEU A 80 381G THR B Protein S 1 FT #SUB 141 291 ASP A 28 337 TYR B Protein A 3 FT #SUB 141 291 ASP A 84 383 LYS B Protein B 4 FT #SUB 141 291 ASP A 85 384 LYS B Protein A 6 FT #SUB 142 292 CYS A 83 382 ALA B Protein B 1 FT #SUB 142 292 CYS A 84 383 LYS B Protein S 1 FT #SUB 117 267 GLY A 144 294 ILE D Protein B 2 FT #SUB 118 268 ASP A 144 294 ILE D Protein A 2 FT #SUB 124 274 THR A 145 295 GLU D Protein S 1 FT #SUB 144 294 ILE A 117 267 GLY D Protein S 2 FT #SUB 144 294 ILE A 118 268 ASP D Protein S 3 FT #SUB 145 295 GLU A 124 274 THR D Protein S 1 FT #SUB 7 151 ASN A 63 372 ARG E Protein S 11 FT #SUB 7 151 ASN A 66 375 ARG E Protein A 7 FT #SUB 141 291 ASP A 13 322 PRO E Protein S 5 FT #SUB 141 291 ASP A 14 323 VAL E Protein S 4 FT #SUB 141 291 ASP A 15 324 GLU E Protein S 1 FT #SUB 142 292 CYS A 11 320 LYS E Protein B 2 FT #SUB 143 293 GLY A 12 321 ILE E Protein B 3 FT #SUB 143 293 GLY A 14 323 VAL E Protein B 3 FT #SUB 144 294 ILE A 11 320 LYS E Protein B 4 FT #SUB 144 294 ILE A 12 321 ILE E Protein B 7 FT #SUB 145 295 GLU A 11 320 LYS E Protein B 3 FT #HET 36 179 ARG A 1 551 0ZZ A S 7 FT #HET 92 236 SER A 1 551 0ZZ A B 4 FT #HET 93 237 HIS A 1 551 0ZZ A A 14 FT #HET 94 238 GLY A 1 551 0ZZ A B 7 FT #HET 95 239 GLU A 1 551 0ZZ A S 4 FT #HET 100 244 PHE A 1 551 0ZZ A S 3 FT #HET 133 283 GLN A 1 551 0ZZ A S 1 FT #HET 134 284 ALA A 1 551 0ZZ A B 2 FT #HET 135 285 CYS A 1 551 0ZZ A A 19 FT DISORDER 1 5 FT DISORDER 146 147 CC SEQUENCE 140 AA (ATOM); CC DNSYKMDYPE MGLCIIINNK NFHKSTGMTS RSGTDVDAAN LRETFRNLKY EVRNKNDLTR CC EEIVELMRDV SKEDHSKRSS FVCVLLSHGE EGIIFGTNGP VDLKKITNFF RGDRCRSLTG CC KPKLFIIQAC RGTELDCGIE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES SGISLDNSYKMDYPEMGLCIIINNKNFHKSTGMTSRSGTDVDAANLRETF CC ATOM -----DNSYKMDYPEMGLCIIINNKNFHKSTGMTSRSGTDVDAANLRETF CC ********************************************* CC SEQRES RNLKYEVRNKNDLTREEIVELMRDVSKEDHSKRSSFVCVLLSHGEEGIIF CC ATOM RNLKYEVRNKNDLTREEIVELMRDVSKEDHSKRSSFVCVLLSHGEEGIIF CC ************************************************** CC SEQRES GTNGPVDLKKITNFFRGDRCRSLTGKPKLFIIQACRGTELDCGIETD CC ATOM GTNGPVDLKKITNFFRGDRCRSLTGKPKLFIIQACRGTELDCGIE-- CC ********************************************* SQ SEQUENCE 147 AA; MW; CN; SGISLDNSYK MDYPEMGLCI IINNKNFHKS TGMTSRSGTD VDAANLRETF RNLKYEVRNK NDLTREEIVE LMRDVSKEDH SKRSSFVCVL LSHGEEGIIF GTNGPVDLKK ITNFFRGDRC RSLTGKPKLF IIQACRGTEL DCGIETD // ID 1RHQB STANDARD; PRT; 102 AA. DT CONVERTED FROM PDB (SEQRES) 1RHQ DE Caspase-3 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.273 FT #SUB 14 323 VAL B 116 266 ARG A Protein A 7 FT #SUB 14 323 VAL B 117 267 GLY A Protein A 8 FT #SUB 14 323 VAL B 118 268 ASP A Protein S 3 FT #SUB 15 324 GLU B 109 259 LYS A Protein S 2 FT #SUB 15 324 GLU B 116 266 ARG A Protein S 3 FT #SUB 16 325 ALA B 128 278 LYS A Protein B 1 FT #SUB 17 326 ASP B 9 153 TYR A Protein A 6 FT #SUB 17 326 ASP B 125 275 GLY A Protein S 3 FT #SUB 17 326 ASP B 126 276 LYS A Protein A 3 FT #SUB 17 326 ASP B 127 277 PRO A Protein B 2 FT #SUB 17 326 ASP B 128 278 LYS A Protein B 5 FT #SUB 18 327 PHE B 112 262 THR A Protein S 3 FT #SUB 18 327 PHE B 116 266 ARG A Protein S 1 FT #SUB 18 327 PHE B 128 278 LYS A Protein A 5 FT #SUB 19 328 LEU B 128 278 LYS A Protein A 4 FT #SUB 19 328 LEU B 129 279 LEU A Protein A 4 FT #SUB 19 328 LEU B 130 280 PHE A Protein B 4 FT #SUB 20 329 TYR B 130 280 PHE A Protein B 1 FT #SUB 21 330 ALA B 130 280 PHE A Protein B 1 FT #SUB 21 330 ALA B 131 281 ILE A Protein B 2 FT #SUB 21 330 ALA B 132 282 ILE A Protein B 2 FT #SUB 22 331 TYR B 108 258 LEU A Protein S 1 FT #SUB 22 331 TYR B 132 282 ILE A Protein A 4 FT #SUB 22 331 TYR B 136 286 ARG A Protein S 14 FT #SUB 23 332 SER B 132 282 ILE A Protein A 3 FT #SUB 23 332 SER B 133 283 GLN A Protein S 6 FT #SUB 23 332 SER B 134 284 ALA A Protein S 2 FT #SUB 24 333 THR B 134 284 ALA A Protein S 1 FT #SUB 24 333 THR B 136 286 ARG A Protein A 6 FT #SUB 25 334 ALA B 136 286 ARG A Protein B 3 FT #SUB 26 335 PRO B 96 240 GLU A Protein A 3 FT #SUB 26 335 PRO B 136 286 ARG A Protein A 10 FT #SUB 27 336 GLY B 96 240 GLU A Protein B 1 FT #SUB 27 336 GLY B 136 286 ARG A Protein B 8 FT #SUB 27 336 GLY B 137 287 GLY A Protein B 4 FT #SUB 27 336 GLY B 138 288 THR A Protein B 4 FT #SUB 27 336 GLY B 139 289 GLU A Protein B 5 FT #SUB 28 337 TYR B 136 286 ARG A Protein B 6 FT #SUB 28 337 TYR B 137 287 GLY A Protein B 4 FT #SUB 28 337 TYR B 139 289 GLU A Protein A 6 FT #SUB 28 337 TYR B 140 290 LEU A Protein S 2 FT #SUB 28 337 TYR B 141 291 ASP A Protein S 3 FT #SUB 29 338 TYR B 135 285 CYS A Protein S 1 FT #SUB 29 338 TYR B 137 287 GLY A Protein S 1 FT #SUB 29 338 TYR B 138 288 THR A Protein S 11 FT #SUB 29 338 TYR B 139 289 GLU A Protein A 4 FT #SUB 29 338 TYR B 140 290 LEU A Protein S 2 FT #SUB 30 339 SER B 133 283 GLN A Protein S 1 FT #SUB 30 339 SER B 134 284 ALA A Protein S 4 FT #SUB 30 339 SER B 135 285 CYS A Protein A 2 FT #SUB 32 341 ARG B 36 179 ARG A Protein S 6 FT #SUB 33 342 ASN B 37 180 SER A Protein B 2 FT #SUB 34 343 SER B 37 180 SER A Protein A 6 FT #SUB 35 344 LYS B 41 184 VAL A Protein B 1 FT #SUB 36 345 ASP B 41 184 VAL A Protein B 6 FT #SUB 37 346 GLY B 42 185 ASP A Protein B 4 FT #SUB 38 347 SER B 36 179 ARG A Protein S 1 FT #SUB 38 347 SER B 42 185 ASP A Protein A 9 FT #SUB 38 347 SER B 133 283 GLN A Protein S 8 FT #SUB 40 349 PHE B 131 281 ILE A Protein S 1 FT #SUB 40 349 PHE B 133 283 GLN A Protein S 2 FT #SUB 41 350 ILE B 42 185 ASP A Protein S 5 FT #SUB 41 350 ILE B 46 189 LEU A Protein S 2 FT #SUB 41 350 ILE B 133 283 GLN A Protein S 5 FT #SUB 45 354 CYS B 45 188 ASN A Protein S 2 FT #SUB 45 354 CYS B 46 189 LEU A Protein S 2 FT #SUB 45 354 CYS B 49 192 THR A Protein A 5 FT #SUB 48 357 LEU B 49 192 THR A Protein S 2 FT #SUB 49 358 LYS B 49 192 THR A Protein S 1 FT #SUB 80 381G THR B 140 290 LEU A Protein B 1 FT #SUB 83 382 ALA B 142 292 CYS A Protein B 1 FT #SUB 84 383 LYS B 141 291 ASP A Protein A 4 FT #SUB 84 383 LYS B 142 292 CYS A Protein S 1 FT #SUB 85 384 LYS B 141 291 ASP A Protein A 6 FT #SUB 89 388 CYS B 136 286 ARG A Protein S 2 FT #SUB 94 394 LEU B 9 153 TYR A Protein A 6 FT #SUB 95 395 THR B 9 153 TYR A Protein A 3 FT #SUB 96 396 LYS B 6 150 ASP A Protein S 4 FT #SUB 96 396 LYS B 7 151 ASN A Protein A 4 FT #SUB 96 396 LYS B 8 152 SER A Protein S 2 FT #SUB 96 396 LYS B 9 153 TYR A Protein A 14 FT #SUB 97 397 GLU B 7 151 ASN A Protein A 7 FT #SUB 97 397 GLU B 8 152 SER A Protein A 6 FT #SUB 97 397 GLU B 9 153 TYR A Protein B 7 FT #SUB 98 398 LEU B 11 155 MET A Protein S 3 FT #SUB 98 398 LEU B 127 277 PRO A Protein S 2 FT #SUB 100 400 PHE B 16 162A MET A Protein B 2 FT #SUB 100 400 PHE B 55 198 TYR A Protein S 2 FT #SUB 101 401 TYR B 11 155 MET A Protein B 1 FT #SUB 101 401 TYR B 16 162A MET A Protein B 1 FT #SUB 11 320 LYS B 142 292 CYS D Protein S 2 FT #SUB 11 320 LYS B 144 294 ILE D Protein B 4 FT #SUB 11 320 LYS B 145 295 GLU D Protein B 3 FT #SUB 12 321 ILE B 143 293 GLY D Protein B 3 FT #SUB 12 321 ILE B 144 294 ILE D Protein B 7 FT #SUB 13 322 PRO B 141 291 ASP D Protein A 6 FT #SUB 14 323 VAL B 141 291 ASP D Protein A 4 FT #SUB 14 323 VAL B 143 293 GLY D Protein S 3 FT #SUB 15 324 GLU B 141 291 ASP D Protein B 1 FT #SUB 63 372 ARG B 7 151 ASN D Protein S 10 FT #SUB 66 375 ARG B 7 151 ASN D Protein S 7 FT #SUB 11 320 LYS B 73 381 GLU E Protein S 1 FT #SUB 11 320 LYS B 83 382 ALA E Protein S 1 FT #SUB 11 320 LYS B 85 384 LYS E Protein B 1 FT #SUB 13 322 PRO B 69 378 ALA E Protein S 7 FT #SUB 13 322 PRO B 85 384 LYS E Protein S 4 FT #SUB 13 322 PRO B 86 385 GLN E Protein S 3 FT #SUB 15 324 GLU B 28 337 TYR E Protein S 8 FT #SUB 15 324 GLU B 87 386 ILE E Protein S 1 FT #SUB 16 325 ALA B 87 386 ILE E Protein A 4 FT #SUB 25 334 ALA B 93 393 MET E Protein S 2 FT #SUB 28 337 TYR B 15 324 GLU E Protein S 8 FT #SUB 56 365 GLU B 59 368 HIS E Protein S 8 FT #SUB 59 368 HIS B 56 365 GLU E Protein S 8 FT #SUB 59 368 HIS B 59 368 HIS E Protein S 12 FT #SUB 59 368 HIS B 97 397 GLU E Protein S 5 FT #SUB 62 371 THR B 95 395 THR E Protein A 3 FT #SUB 62 371 THR B 96 396 LYS E Protein S 4 FT #SUB 65 374 ASN B 94 394 LEU E Protein S 2 FT #SUB 66 375 ARG B 95 395 THR E Protein S 7 FT #SUB 66 375 ARG B 96 396 LYS E Protein S 2 FT #SUB 69 378 ALA B 13 322 PRO E Protein A 7 FT #SUB 73 381 GLU B 11 320 LYS E Protein S 1 FT #SUB 83 382 ALA B 11 320 LYS E Protein B 1 FT #SUB 85 384 LYS B 11 320 LYS E Protein S 1 FT #SUB 85 384 LYS B 13 322 PRO E Protein S 4 FT #SUB 86 385 GLN B 13 322 PRO E Protein B 3 FT #SUB 87 386 ILE B 15 324 GLU E Protein S 1 FT #SUB 87 386 ILE B 16 325 ALA E Protein S 3 FT #SUB 87 386 ILE B 93 393 MET E Protein S 1 FT #SUB 90 389 ILE B 90 389 ILE E Protein B 1 FT #SUB 90 389 ILE B 91 390 VAL E Protein B 2 FT #SUB 90 389 ILE B 92 392 SER E Protein A 3 FT #SUB 91 390 VAL B 90 389 ILE E Protein B 2 FT #SUB 91 390 VAL B 91 390 VAL E Protein S 1 FT #SUB 92 392 SER B 90 389 ILE E Protein B 3 FT #SUB 93 393 MET B 25 334 ALA E Protein S 2 FT #SUB 93 393 MET B 87 386 ILE E Protein B 1 FT #SUB 94 394 LEU B 65 374 ASN E Protein B 2 FT #SUB 95 395 THR B 62 371 THR E Protein B 3 FT #SUB 95 395 THR B 66 375 ARG E Protein B 7 FT #SUB 96 396 LYS B 62 371 THR E Protein B 4 FT #SUB 96 396 LYS B 66 375 ARG E Protein A 2 FT #SUB 97 397 GLU B 59 368 HIS E Protein S 5 FT #HET 29 338 TYR B 1 551 0ZZ A S 3 FT #HET 30 339 SER B 1 551 0ZZ A B 6 FT #HET 31 340 TRP B 1 551 0ZZ A A 17 FT #HET 32 341 ARG B 1 551 0ZZ A A 18 FT #HET 74 381A SER B 1 551 0ZZ A S 1 FT #HET 75 381B PHE B 1 551 0ZZ A B 3 FT #HET 76 381C SER B 1 551 0ZZ A S 1 FT DISORDER 1 10 FT DISORDER 102 102 CC SEQUENCE 91 AA (ATOM); CC KIPVEADFLY AYSTAPGYYS WRNSKDGSWF IQSLCAMLKQ YADKLEFMHI LTRVNRKVAT CC EFESFSFDAT FHAKKQIPCI VSMLTKELYF Y CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES SGVDDDMACHKIPVEADFLYAYSTAPGYYSWRNSKDGSWFIQSLCAMLKQ CC ATOM ----------KIPVEADFLYAYSTAPGYYSWRNSKDGSWFIQSLCAMLKQ CC **************************************** CC SEQRES YADKLEFMHILTRVNRKVATEFESFSFDATFHAKKQIPCIVSMLTKELYF CC ATOM YADKLEFMHILTRVNRKVATEFESFSFDATFHAKKQIPCIVSMLTKELYF CC ************************************************** CC SEQRES YH CC ATOM Y- CC * SQ SEQUENCE 102 AA; MW; CN; SGVDDDMACH KIPVEADFLY AYSTAPGYYS WRNSKDGSWF IQSLCAMLKQ YADKLEFMHI LTRVNRKVAT EFESFSFDAT FHAKKQIPCI VSMLTKELYF YH // ID 1RHQD STANDARD; PRT; 147 AA. DT CONVERTED FROM PDB (SEQRES) 1RHQ DE Caspase-3 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.273 FT #SUB 117 267 GLY D 144 294 ILE A Protein B 2 FT #SUB 118 268 ASP D 144 294 ILE A Protein A 3 FT #SUB 124 274 THR D 145 295 GLU A Protein S 1 FT #SUB 144 294 ILE D 117 267 GLY A Protein S 2 FT #SUB 144 294 ILE D 118 268 ASP A Protein S 2 FT #SUB 145 295 GLU D 124 274 THR A Protein S 1 FT #SUB 7 151 ASN D 63 372 ARG B Protein S 10 FT #SUB 7 151 ASN D 66 375 ARG B Protein A 7 FT #SUB 141 291 ASP D 13 322 PRO B Protein S 6 FT #SUB 141 291 ASP D 14 323 VAL B Protein S 4 FT #SUB 141 291 ASP D 15 324 GLU B Protein S 1 FT #SUB 142 292 CYS D 11 320 LYS B Protein B 2 FT #SUB 143 293 GLY D 12 321 ILE B Protein B 3 FT #SUB 143 293 GLY D 14 323 VAL B Protein B 3 FT #SUB 144 294 ILE D 11 320 LYS B Protein B 4 FT #SUB 144 294 ILE D 12 321 ILE B Protein B 7 FT #SUB 145 295 GLU D 11 320 LYS B Protein B 3 FT #SUB 6 150 ASP D 96 396 LYS E Protein B 4 FT #SUB 7 151 ASN D 96 396 LYS E Protein B 4 FT #SUB 7 151 ASN D 97 397 GLU E Protein B 6 FT #SUB 8 152 SER D 96 396 LYS E Protein B 2 FT #SUB 8 152 SER D 97 397 GLU E Protein A 6 FT #SUB 9 153 TYR D 17 326 ASP E Protein S 6 FT #SUB 9 153 TYR D 94 394 LEU E Protein S 6 FT #SUB 9 153 TYR D 95 395 THR E Protein S 3 FT #SUB 9 153 TYR D 96 396 LYS E Protein A 14 FT #SUB 9 153 TYR D 97 397 GLU E Protein A 7 FT #SUB 11 155 MET D 98 398 LEU E Protein S 3 FT #SUB 11 155 MET D 101 401 TYR E Protein B 1 FT #SUB 16 162A MET D 100 400 PHE E Protein S 2 FT #SUB 16 162A MET D 101 401 TYR E Protein S 1 FT #SUB 36 179 ARG D 32 341 ARG E Protein A 6 FT #SUB 36 179 ARG D 38 347 SER E Protein S 1 FT #SUB 37 180 SER D 33 342 ASN E Protein B 2 FT #SUB 37 180 SER D 34 343 SER E Protein A 6 FT #SUB 41 184 VAL D 35 344 LYS E Protein S 1 FT #SUB 41 184 VAL D 36 345 ASP E Protein S 6 FT #SUB 42 185 ASP D 37 346 GLY E Protein S 4 FT #SUB 42 185 ASP D 38 347 SER E Protein S 9 FT #SUB 42 185 ASP D 41 350 ILE E Protein S 5 FT #SUB 45 188 ASN D 45 354 CYS E Protein S 2 FT #SUB 46 189 LEU D 41 350 ILE E Protein S 3 FT #SUB 46 189 LEU D 45 354 CYS E Protein A 2 FT #SUB 49 192 THR D 45 354 CYS E Protein S 5 FT #SUB 49 192 THR D 48 357 LEU E Protein S 2 FT #SUB 49 192 THR D 49 358 LYS E Protein S 1 FT #SUB 55 198 TYR D 100 400 PHE E Protein S 2 FT #SUB 96 240 GLU D 26 335 PRO E Protein S 3 FT #SUB 96 240 GLU D 27 336 GLY E Protein S 1 FT #SUB 108 258 LEU D 22 331 TYR E Protein S 1 FT #SUB 109 259 LYS D 15 324 GLU E Protein S 2 FT #SUB 112 262 THR D 18 327 PHE E Protein A 3 FT #SUB 116 266 ARG D 14 323 VAL E Protein A 7 FT #SUB 116 266 ARG D 15 324 GLU E Protein S 3 FT #SUB 116 266 ARG D 18 327 PHE E Protein B 1 FT #SUB 117 267 GLY D 14 323 VAL E Protein B 8 FT #SUB 118 268 ASP D 14 323 VAL E Protein A 3 FT #SUB 125 275 GLY D 17 326 ASP E Protein B 3 FT #SUB 126 276 LYS D 17 326 ASP E Protein B 3 FT #SUB 127 277 PRO D 17 326 ASP E Protein B 2 FT #SUB 127 277 PRO D 98 398 LEU E Protein S 2 FT #SUB 128 278 LYS D 16 325 ALA E Protein S 1 FT #SUB 128 278 LYS D 17 326 ASP E Protein A 5 FT #SUB 128 278 LYS D 18 327 PHE E Protein A 5 FT #SUB 128 278 LYS D 19 328 LEU E Protein B 4 FT #SUB 129 279 LEU D 19 328 LEU E Protein A 4 FT #SUB 130 280 PHE D 19 328 LEU E Protein A 4 FT #SUB 130 280 PHE D 20 329 TYR E Protein B 1 FT #SUB 130 280 PHE D 21 330 ALA E Protein B 1 FT #SUB 131 281 ILE D 21 330 ALA E Protein A 2 FT #SUB 131 281 ILE D 40 349 PHE E Protein S 1 FT #SUB 132 282 ILE D 21 330 ALA E Protein B 2 FT #SUB 132 282 ILE D 22 331 TYR E Protein A 4 FT #SUB 132 282 ILE D 23 332 SER E Protein B 3 FT #SUB 133 283 GLN D 23 332 SER E Protein A 6 FT #SUB 133 283 GLN D 30 339 SER E Protein S 1 FT #SUB 133 283 GLN D 38 347 SER E Protein S 8 FT #SUB 133 283 GLN D 40 349 PHE E Protein S 2 FT #SUB 133 283 GLN D 41 350 ILE E Protein S 5 FT #SUB 134 284 ALA D 23 332 SER E Protein B 2 FT #SUB 134 284 ALA D 24 333 THR E Protein B 1 FT #SUB 134 284 ALA D 30 339 SER E Protein B 4 FT #SUB 135 285 CYS D 29 338 TYR E Protein S 1 FT #SUB 135 285 CYS D 30 339 SER E Protein A 2 FT #SUB 136 286 ARG D 22 331 TYR E Protein S 14 FT #SUB 136 286 ARG D 24 333 THR E Protein S 6 FT #SUB 136 286 ARG D 25 334 ALA E Protein S 3 FT #SUB 136 286 ARG D 26 335 PRO E Protein A 10 FT #SUB 136 286 ARG D 27 336 GLY E Protein A 8 FT #SUB 136 286 ARG D 28 337 TYR E Protein A 6 FT #SUB 136 286 ARG D 89 388 CYS E Protein S 2 FT #SUB 137 287 GLY D 27 336 GLY E Protein B 4 FT #SUB 137 287 GLY D 28 337 TYR E Protein B 4 FT #SUB 137 287 GLY D 29 338 TYR E Protein B 1 FT #SUB 138 288 THR D 27 336 GLY E Protein B 4 FT #SUB 138 288 THR D 29 338 TYR E Protein A 11 FT #SUB 139 289 GLU D 27 336 GLY E Protein A 5 FT #SUB 139 289 GLU D 28 337 TYR E Protein A 6 FT #SUB 139 289 GLU D 29 338 TYR E Protein B 4 FT #SUB 140 290 LEU D 28 337 TYR E Protein B 2 FT #SUB 140 290 LEU D 29 338 TYR E Protein S 2 FT #SUB 140 290 LEU D 80 381G THR E Protein S 1 FT #SUB 141 291 ASP D 28 337 TYR E Protein A 3 FT #SUB 141 291 ASP D 84 383 LYS E Protein B 4 FT #SUB 141 291 ASP D 85 384 LYS E Protein A 6 FT #SUB 142 292 CYS D 83 382 ALA E Protein B 1 FT #SUB 142 292 CYS D 84 383 LYS E Protein S 1 FT #HET 36 179 ARG D 2 551 0ZZ D S 7 FT #HET 92 236 SER D 2 551 0ZZ D B 4 FT #HET 93 237 HIS D 2 551 0ZZ D A 14 FT #HET 94 238 GLY D 2 551 0ZZ D B 7 FT #HET 95 239 GLU D 2 551 0ZZ D S 4 FT #HET 100 244 PHE D 2 551 0ZZ D S 3 FT #HET 133 283 GLN D 2 551 0ZZ D S 1 FT #HET 134 284 ALA D 2 551 0ZZ D B 2 FT #HET 135 285 CYS D 2 551 0ZZ D A 19 FT DISORDER 1 5 FT DISORDER 146 147 CC SEQUENCE 140 AA (ATOM); CC DNSYKMDYPE MGLCIIINNK NFHKSTGMTS RSGTDVDAAN LRETFRNLKY EVRNKNDLTR CC EEIVELMRDV SKEDHSKRSS FVCVLLSHGE EGIIFGTNGP VDLKKITNFF RGDRCRSLTG CC KPKLFIIQAC RGTELDCGIE CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES SGISLDNSYKMDYPEMGLCIIINNKNFHKSTGMTSRSGTDVDAANLRETF CC ATOM -----DNSYKMDYPEMGLCIIINNKNFHKSTGMTSRSGTDVDAANLRETF CC ********************************************* CC SEQRES RNLKYEVRNKNDLTREEIVELMRDVSKEDHSKRSSFVCVLLSHGEEGIIF CC ATOM RNLKYEVRNKNDLTREEIVELMRDVSKEDHSKRSSFVCVLLSHGEEGIIF CC ************************************************** CC SEQRES GTNGPVDLKKITNFFRGDRCRSLTGKPKLFIIQACRGTELDCGIETD CC ATOM GTNGPVDLKKITNFFRGDRCRSLTGKPKLFIIQACRGTELDCGIE-- CC ********************************************* SQ SEQUENCE 147 AA; MW; CN; SGISLDNSYK MDYPEMGLCI IINNKNFHKS TGMTSRSGTD VDAANLRETF RNLKYEVRNK NDLTREEIVE LMRDVSKEDH SKRSSFVCVL LSHGEEGIIF GTNGPVDLKK ITNFFRGDRC RSLTGKPKLF IIQACRGTEL DCGIETD // ID 1RHQE STANDARD; PRT; 102 AA. DT CONVERTED FROM PDB (SEQRES) 1RHQ DE Caspase-3 OS Homo sapiens CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.000 CC R-Factor 0.273 FT #SUB 11 320 LYS E 142 292 CYS A Protein S 2 FT #SUB 11 320 LYS E 144 294 ILE A Protein B 4 FT #SUB 11 320 LYS E 145 295 GLU A Protein B 3 FT #SUB 12 321 ILE E 143 293 GLY A Protein B 3 FT #SUB 12 321 ILE E 144 294 ILE A Protein B 7 FT #SUB 13 322 PRO E 141 291 ASP A Protein A 5 FT #SUB 14 323 VAL E 141 291 ASP A Protein A 4 FT #SUB 14 323 VAL E 143 293 GLY A Protein S 3 FT #SUB 15 324 GLU E 141 291 ASP A Protein B 1 FT #SUB 63 372 ARG E 7 151 ASN A Protein S 11 FT #SUB 66 375 ARG E 7 151 ASN A Protein S 7 FT #SUB 11 320 LYS E 73 381 GLU B Protein S 1 FT #SUB 11 320 LYS E 83 382 ALA B Protein S 1 FT #SUB 11 320 LYS E 85 384 LYS B Protein B 1 FT #SUB 13 322 PRO E 69 378 ALA B Protein S 7 FT #SUB 13 322 PRO E 85 384 LYS B Protein S 4 FT #SUB 13 322 PRO E 86 385 GLN B Protein S 3 FT #SUB 15 324 GLU E 28 337 TYR B Protein S 8 FT #SUB 15 324 GLU E 87 386 ILE B Protein S 1 FT #SUB 16 325 ALA E 87 386 ILE B Protein A 3 FT #SUB 25 334 ALA E 93 393 MET B Protein S 2 FT #SUB 28 337 TYR E 15 324 GLU B Protein S 8 FT #SUB 56 365 GLU E 59 368 HIS B Protein S 8 FT #SUB 59 368 HIS E 56 365 GLU B Protein S 8 FT #SUB 59 368 HIS E 59 368 HIS B Protein S 12 FT #SUB 59 368 HIS E 97 397 GLU B Protein S 5 FT #SUB 62 371 THR E 95 395 THR B Protein A 3 FT #SUB 62 371 THR E 96 396 LYS B Protein S 4 FT #SUB 65 374 ASN E 94 394 LEU B Protein S 2 FT #SUB 66 375 ARG E 95 395 THR B Protein S 7 FT #SUB 66 375 ARG E 96 396 LYS B Protein S 2 FT #SUB 69 378 ALA E 13 322 PRO B Protein A 7 FT #SUB 73 381 GLU E 11 320 LYS B Protein S 1 FT #SUB 83 382 ALA E 11 320 LYS B Protein B 1 FT #SUB 85 384 LYS E 11 320 LYS B Protein S 1 FT #SUB 85 384 LYS E 13 322 PRO B Protein S 4 FT #SUB 86 385 GLN E 13 322 PRO B Protein B 3 FT #SUB 87 386 ILE E 15 324 GLU B Protein S 1 FT #SUB 87 386 ILE E 16 325 ALA B Protein S 4 FT #SUB 87 386 ILE E 93 393 MET B Protein S 1 FT #SUB 90 389 ILE E 90 389 ILE B Protein B 1 FT #SUB 90 389 ILE E 91 390 VAL B Protein B 2 FT #SUB 90 389 ILE E 92 392 SER B Protein A 3 FT #SUB 91 390 VAL E 90 389 ILE B Protein B 2 FT #SUB 91 390 VAL E 91 390 VAL B Protein S 1 FT #SUB 92 392 SER E 90 389 ILE B Protein B 3 FT #SUB 93 393 MET E 25 334 ALA B Protein S 2 FT #SUB 93 393 MET E 87 386 ILE B Protein B 1 FT #SUB 94 394 LEU E 65 374 ASN B Protein B 2 FT #SUB 95 395 THR E 62 371 THR B Protein B 3 FT #SUB 95 395 THR E 66 375 ARG B Protein B 7 FT #SUB 96 396 LYS E 62 371 THR B Protein B 4 FT #SUB 96 396 LYS E 66 375 ARG B Protein A 2 FT #SUB 97 397 GLU E 59 368 HIS B Protein S 5 FT #SUB 14 323 VAL E 116 266 ARG D Protein A 7 FT #SUB 14 323 VAL E 117 267 GLY D Protein A 8 FT #SUB 14 323 VAL E 118 268 ASP D Protein S 3 FT #SUB 15 324 GLU E 109 259 LYS D Protein S 2 FT #SUB 15 324 GLU E 116 266 ARG D Protein S 3 FT #SUB 16 325 ALA E 128 278 LYS D Protein B 1 FT #SUB 17 326 ASP E 9 153 TYR D Protein A 6 FT #SUB 17 326 ASP E 125 275 GLY D Protein S 3 FT #SUB 17 326 ASP E 126 276 LYS D Protein A 3 FT #SUB 17 326 ASP E 127 277 PRO D Protein B 2 FT #SUB 17 326 ASP E 128 278 LYS D Protein B 5 FT #SUB 18 327 PHE E 112 262 THR D Protein S 3 FT #SUB 18 327 PHE E 116 266 ARG D Protein S 1 FT #SUB 18 327 PHE E 128 278 LYS D Protein A 5 FT #SUB 19 328 LEU E 128 278 LYS D Protein A 4 FT #SUB 19 328 LEU E 129 279 LEU D Protein A 4 FT #SUB 19 328 LEU E 130 280 PHE D Protein B 4 FT #SUB 20 329 TYR E 130 280 PHE D Protein B 1 FT #SUB 21 330 ALA E 130 280 PHE D Protein B 1 FT #SUB 21 330 ALA E 131 281 ILE D Protein B 2 FT #SUB 21 330 ALA E 132 282 ILE D Protein B 2 FT #SUB 22 331 TYR E 108 258 LEU D Protein S 1 FT #SUB 22 331 TYR E 132 282 ILE D Protein A 4 FT #SUB 22 331 TYR E 136 286 ARG D Protein S 14 FT #SUB 23 332 SER E 132 282 ILE D Protein A 3 FT #SUB 23 332 SER E 133 283 GLN D Protein S 6 FT #SUB 23 332 SER E 134 284 ALA D Protein S 2 FT #SUB 24 333 THR E 134 284 ALA D Protein S 1 FT #SUB 24 333 THR E 136 286 ARG D Protein A 6 FT #SUB 25 334 ALA E 136 286 ARG D Protein B 3 FT #SUB 26 335 PRO E 96 240 GLU D Protein A 3 FT #SUB 26 335 PRO E 136 286 ARG D Protein A 10 FT #SUB 27 336 GLY E 96 240 GLU D Protein B 1 FT #SUB 27 336 GLY E 136 286 ARG D Protein B 8 FT #SUB 27 336 GLY E 137 287 GLY D Protein B 4 FT #SUB 27 336 GLY E 138 288 THR D Protein B 4 FT #SUB 27 336 GLY E 139 289 GLU D Protein B 5 FT #SUB 28 337 TYR E 136 286 ARG D Protein B 6 FT #SUB 28 337 TYR E 137 287 GLY D Protein B 4 FT #SUB 28 337 TYR E 139 289 GLU D Protein A 6 FT #SUB 28 337 TYR E 140 290 LEU D Protein S 2 FT #SUB 28 337 TYR E 141 291 ASP D Protein S 3 FT #SUB 29 338 TYR E 135 285 CYS D Protein S 1 FT #SUB 29 338 TYR E 137 287 GLY D Protein S 1 FT #SUB 29 338 TYR E 138 288 THR D Protein S 11 FT #SUB 29 338 TYR E 139 289 GLU D Protein A 4 FT #SUB 29 338 TYR E 140 290 LEU D Protein S 2 FT #SUB 30 339 SER E 133 283 GLN D Protein S 1 FT #SUB 30 339 SER E 134 284 ALA D Protein S 4 FT #SUB 30 339 SER E 135 285 CYS D Protein A 2 FT #SUB 32 341 ARG E 36 179 ARG D Protein S 6 FT #SUB 33 342 ASN E 37 180 SER D Protein B 2 FT #SUB 34 343 SER E 37 180 SER D Protein A 6 FT #SUB 35 344 LYS E 41 184 VAL D Protein B 1 FT #SUB 36 345 ASP E 41 184 VAL D Protein B 6 FT #SUB 37 346 GLY E 42 185 ASP D Protein B 4 FT #SUB 38 347 SER E 36 179 ARG D Protein S 1 FT #SUB 38 347 SER E 42 185 ASP D Protein A 9 FT #SUB 38 347 SER E 133 283 GLN D Protein S 8 FT #SUB 40 349 PHE E 131 281 ILE D Protein S 1 FT #SUB 40 349 PHE E 133 283 GLN D Protein S 2 FT #SUB 41 350 ILE E 42 185 ASP D Protein S 5 FT #SUB 41 350 ILE E 46 189 LEU D Protein S 3 FT #SUB 41 350 ILE E 133 283 GLN D Protein S 5 FT #SUB 45 354 CYS E 45 188 ASN D Protein S 2 FT #SUB 45 354 CYS E 46 189 LEU D Protein S 2 FT #SUB 45 354 CYS E 49 192 THR D Protein A 5 FT #SUB 48 357 LEU E 49 192 THR D Protein S 2 FT #SUB 49 358 LYS E 49 192 THR D Protein S 1 FT #SUB 80 381G THR E 140 290 LEU D Protein B 1 FT #SUB 83 382 ALA E 142 292 CYS D Protein B 1 FT #SUB 84 383 LYS E 141 291 ASP D Protein A 4 FT #SUB 84 383 LYS E 142 292 CYS D Protein S 1 FT #SUB 85 384 LYS E 141 291 ASP D Protein A 6 FT #SUB 89 388 CYS E 136 286 ARG D Protein S 2 FT #SUB 94 394 LEU E 9 153 TYR D Protein A 6 FT #SUB 95 395 THR E 9 153 TYR D Protein A 3 FT #SUB 96 396 LYS E 6 150 ASP D Protein S 4 FT #SUB 96 396 LYS E 7 151 ASN D Protein A 4 FT #SUB 96 396 LYS E 8 152 SER D Protein S 2 FT #SUB 96 396 LYS E 9 153 TYR D Protein A 14 FT #SUB 97 397 GLU E 7 151 ASN D Protein A 6 FT #SUB 97 397 GLU E 8 152 SER D Protein A 6 FT #SUB 97 397 GLU E 9 153 TYR D Protein B 7 FT #SUB 98 398 LEU E 11 155 MET D Protein S 3 FT #SUB 98 398 LEU E 127 277 PRO D Protein S 2 FT #SUB 100 400 PHE E 16 162A MET D Protein B 2 FT #SUB 100 400 PHE E 55 198 TYR D Protein S 2 FT #SUB 101 401 TYR E 11 155 MET D Protein B 1 FT #SUB 101 401 TYR E 16 162A MET D Protein B 1 FT #HET 29 338 TYR E 2 551 0ZZ D S 3 FT #HET 30 339 SER E 2 551 0ZZ D B 6 FT #HET 31 340 TRP E 2 551 0ZZ D A 17 FT #HET 32 341 ARG E 2 551 0ZZ D A 18 FT #HET 74 381A SER E 2 551 0ZZ D S 1 FT #HET 75 381B PHE E 2 551 0ZZ D B 3 FT #HET 76 381C SER E 2 551 0ZZ D S 1 FT DISORDER 1 10 FT DISORDER 102 102 CC SEQUENCE 91 AA (ATOM); CC KIPVEADFLY AYSTAPGYYS WRNSKDGSWF IQSLCAMLKQ YADKLEFMHI LTRVNRKVAT CC EFESFSFDAT FHAKKQIPCI VSMLTKELYF Y CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES SGVDDDMACHKIPVEADFLYAYSTAPGYYSWRNSKDGSWFIQSLCAMLKQ CC ATOM ----------KIPVEADFLYAYSTAPGYYSWRNSKDGSWFIQSLCAMLKQ CC **************************************** CC SEQRES YADKLEFMHILTRVNRKVATEFESFSFDATFHAKKQIPCIVSMLTKELYF CC ATOM YADKLEFMHILTRVNRKVATEFESFSFDATFHAKKQIPCIVSMLTKELYF CC ************************************************** CC SEQRES YH CC ATOM Y- CC * SQ SEQUENCE 102 AA; MW; CN; SGVDDDMACH KIPVEADFLY AYSTAPGYYS WRNSKDGSWF IQSLCAMLKQ YADKLEFMHI LTRVNRKVAT EFESFSFDAT FHAKKQIPCI VSMLTKELYF YH //