ID 1T1SA STANDARD; PRT; 398 AA. DT CONVERTED FROM PDB (SEQRES) 1T1S DE 1-deoxy-D-xylulose 5-phosphate reductoisomerase OS Escherichia coli CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.400 CC R-Factor 0.213 FT #SUB 158 157 GLN A 266 265 SER B Protein S 4 FT #SUB 158 157 GLN A 268 267 LEU B Protein A 2 FT #SUB 162 161 GLN A 162 161 GLN B Protein S 10 FT #SUB 177 176 GLY A 289 288 ARG B Protein B 2 FT #SUB 182 181 LEU A 299 298 PHE B Protein S 1 FT #SUB 249 248 LEU A 299 298 PHE B Protein S 2 FT #SUB 259 258 MET A 299 298 PHE B Protein S 6 FT #SUB 261 260 ARG A 296 295 PRO B Protein S 2 FT #SUB 261 260 ARG A 297 296 LEU B Protein S 3 FT #SUB 261 260 ARG A 299 298 PHE B Protein S 2 FT #SUB 262 261 TYR A 289 288 ARG B Protein S 12 FT #SUB 263 262 GLN A 289 288 ARG B Protein S 2 FT #SUB 263 262 GLN A 290 289 VAL B Protein A 9 FT #SUB 263 262 GLN A 291 290 ASN B Protein A 5 FT #SUB 264 263 ASP A 278 277 THR B Protein A 6 FT #SUB 264 263 ASP A 281 280 ALA B Protein S 1 FT #SUB 264 263 ASP A 282 281 HIS B Protein S 2 FT #SUB 264 263 ASP A 289 288 ARG B Protein S 2 FT #SUB 264 263 ASP A 290 289 VAL B Protein A 3 FT #SUB 264 263 ASP A 292 291 SER B Protein A 6 FT #SUB 264 263 ASP A 294 293 VAL B Protein B 1 FT #SUB 265 264 GLY A 271 270 LEU B Protein B 1 FT #SUB 266 265 SER A 158 157 GLN B Protein S 5 FT #SUB 266 265 SER A 270 269 GLN B Protein A 3 FT #SUB 266 265 SER A 271 270 LEU B Protein B 2 FT #SUB 266 265 SER A 278 277 THR B Protein A 2 FT #SUB 267 266 VAL A 269 268 ALA B Protein B 1 FT #SUB 267 266 VAL A 270 269 GLN B Protein B 2 FT #SUB 267 266 VAL A 271 270 LEU B Protein A 9 FT #SUB 267 266 VAL A 299 298 PHE B Protein S 1 FT #SUB 268 267 LEU A 158 157 GLN B Protein S 1 FT #SUB 268 267 LEU A 269 268 ALA B Protein B 2 FT #SUB 268 267 LEU A 270 269 GLN B Protein S 2 FT #SUB 269 268 ALA A 267 266 VAL B Protein B 1 FT #SUB 269 268 ALA A 268 267 LEU B Protein B 4 FT #SUB 269 268 ALA A 269 268 ALA B Protein B 7 FT #SUB 270 269 GLN A 266 265 SER B Protein S 3 FT #SUB 270 269 GLN A 267 266 VAL B Protein B 2 FT #SUB 270 269 GLN A 268 267 LEU B Protein A 3 FT #SUB 271 270 LEU A 266 265 SER B Protein B 2 FT #SUB 271 270 LEU A 267 266 VAL B Protein A 10 FT #SUB 278 277 THR A 264 263 ASP B Protein A 8 FT #SUB 278 277 THR A 266 265 SER B Protein S 2 FT #SUB 281 280 ALA A 264 263 ASP B Protein S 1 FT #SUB 282 281 HIS A 264 263 ASP B Protein A 3 FT #SUB 289 288 ARG A 176 175 ASN B Protein S 1 FT #SUB 289 288 ARG A 177 176 GLY B Protein S 2 FT #SUB 289 288 ARG A 262 261 TYR B Protein S 9 FT #SUB 289 288 ARG A 263 262 GLN B Protein B 2 FT #SUB 289 288 ARG A 264 263 ASP B Protein S 5 FT #SUB 289 288 ARG A 266 265 SER B Protein S 2 FT #SUB 290 289 VAL A 263 262 GLN B Protein B 11 FT #SUB 290 289 VAL A 264 263 ASP B Protein B 3 FT #SUB 291 290 ASN A 263 262 GLN B Protein A 5 FT #SUB 292 291 SER A 264 263 ASP B Protein S 5 FT #SUB 296 295 PRO A 261 260 ARG B Protein A 5 FT #SUB 297 296 LEU A 261 260 ARG B Protein A 6 FT #SUB 297 296 LEU A 267 266 VAL B Protein S 1 FT #SUB 299 298 PHE A 182 181 LEU B Protein S 1 FT #SUB 299 298 PHE A 249 248 LEU B Protein S 2 FT #SUB 299 298 PHE A 259 258 MET B Protein S 6 FT #SUB 299 298 PHE A 267 266 VAL B Protein S 1 FT #SUB 299 298 PHE A 307 306 PHE B Protein A 8 FT #SUB 300 299 CYS A 308 307 ALA B Protein S 1 FT #SUB 300 299 CYS A 309 308 ALA B Protein S 2 FT #SUB 304 303 ALA A 304 303 ALA B Protein S 1 FT #SUB 304 303 ALA A 305 304 LEU B Protein B 2 FT #SUB 304 303 ALA A 306 305 THR B Protein S 1 FT #SUB 305 304 LEU A 304 303 ALA B Protein B 3 FT #SUB 305 304 LEU A 305 304 LEU B Protein A 11 FT #SUB 306 305 THR A 304 303 ALA B Protein S 1 FT #SUB 307 306 PHE A 299 298 PHE B Protein S 7 FT #SUB 308 307 ALA A 300 299 CYS B Protein B 1 FT #SUB 309 308 ALA A 300 299 CYS B Protein A 2 FT #HET 125 124 LYS A 2 1002 MG A S 2 FT #HET 125 124 LYS A 3 2001 CBQ A S 7 FT #HET 150 149 ASP A 2 1002 MG A S 3 FT #HET 150 149 ASP A 3 2001 CBQ A A 7 FT #HET 151 150 SER A 3 2001 CBQ A A 13 FT #HET 152 151 GLU A 2 1002 MG A S 3 FT #HET 152 151 GLU A 3 2001 CBQ A S 11 FT #HET 185 184 GLY A 1 1001 SO4 A B 2 FT #HET 186 185 SER A 1 1001 SO4 A A 8 FT #HET 209 208 HIS A 1 1001 SO4 A S 5 FT #HET 212 211 TRP A 1 1001 SO4 A S 1 FT #HET 212 211 TRP A 3 2001 CBQ A S 13 FT #HET 214 213 MET A 3 2001 CBQ A S 2 FT #HET 218 217 ILE A 3 2001 CBQ A S 2 FT #HET 222 221 SER A 1 1001 SO4 A A 6 FT #HET 227 226 ASN A 3 2001 CBQ A S 6 FT #HET 228 227 LYS A 1 1001 SO4 A S 6 FT #HET 231 230 GLU A 2 1002 MG A S 4 FT #HET 231 230 GLU A 3 2001 CBQ A S 4 FT #HET 257 256 HIS A 3 2001 CBQ A S 2 FT #HET 274 273 PRO A 3 2001 CBQ A A 2 FT #HET 276 275 MET A 3 2001 CBQ A S 2 CC SEQUENCE 398 AA (ATOM); CC GKQLTILGST GSIGCSTLDV VRHNPEHFRV VALVAGKNVT RMVEQCLEFS PRYAVMDDEA CC SAKLLKTMLQ QQGSRTEVLS GQQAACDMAA LEDVDQVMAA IVGAAGLLPT LAAIRAGKTI CC LLANKESLVT CGRLFMDAVK QSKAQLLPVD SEHNAIFQSL PQPIQHNLGY ADLEQNGVVS CC ILLTGSGGPF RETPLRDLAT MTPDQACRHP NWSMGRKISV DSATMMNKGL EYIEARWLFN CC ASASQMEVLI HPQSVIHSMV RYQDGSVLAQ LGEPDMRTPI AHTMAWPNRV NSGVKPLDFC CC KLSALTFAAP DYDRYPCLKL AMEAFEQGQA ATTALNAANE ITVAAFLAQQ IRFTDIAALN CC LSVLEKMDMR EPQCVDDVLS VDANAREVAR KEVMRLAS CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GKQLTILGSTGSIGCSTLDVVRHNPEHFRVVALVAGKNVTRMVEQCLEFS CC ATOM GKQLTILGSTGSIGCSTLDVVRHNPEHFRVVALVAGKNVTRMVEQCLEFS CC ************************************************** CC SEQRES PRYAVMDDEASAKLLKTMLQQQGSRTEVLSGQQAACDMAALEDVDQVMAA CC ATOM PRYAVMDDEASAKLLKTMLQQQGSRTEVLSGQQAACDMAALEDVDQVMAA CC ************************************************** CC SEQRES IVGAAGLLPTLAAIRAGKTILLANKESLVTCGRLFMDAVKQSKAQLLPVD CC ATOM IVGAAGLLPTLAAIRAGKTILLANKESLVTCGRLFMDAVKQSKAQLLPVD CC ************************************************** CC SEQRES SEHNAIFQSLPQPIQHNLGYADLEQNGVVSILLTGSGGPFRETPLRDLAT CC ATOM SEHNAIFQSLPQPIQHNLGYADLEQNGVVSILLTGSGGPFRETPLRDLAT CC ************************************************** CC SEQRES MTPDQACRHPNWSMGRKISVDSATMMNKGLEYIEARWLFNASASQMEVLI CC ATOM MTPDQACRHPNWSMGRKISVDSATMMNKGLEYIEARWLFNASASQMEVLI CC ************************************************** CC SEQRES HPQSVIHSMVRYQDGSVLAQLGEPDMRTPIAHTMAWPNRVNSGVKPLDFC CC ATOM HPQSVIHSMVRYQDGSVLAQLGEPDMRTPIAHTMAWPNRVNSGVKPLDFC CC ************************************************** CC SEQRES KLSALTFAAPDYDRYPCLKLAMEAFEQGQAATTALNAANEITVAAFLAQQ CC ATOM KLSALTFAAPDYDRYPCLKLAMEAFEQGQAATTALNAANEITVAAFLAQQ CC ************************************************** CC SEQRES IRFTDIAALNLSVLEKMDMREPQCVDDVLSVDANAREVARKEVMRLAS CC ATOM IRFTDIAALNLSVLEKMDMREPQCVDDVLSVDANAREVARKEVMRLAS CC ************************************************ SQ SEQUENCE 398 AA; MW; CN; GKQLTILGST GSIGCSTLDV VRHNPEHFRV VALVAGKNVT RMVEQCLEFS PRYAVMDDEA SAKLLKTMLQ QQGSRTEVLS GQQAACDMAA LEDVDQVMAA IVGAAGLLPT LAAIRAGKTI LLANKESLVT CGRLFMDAVK QSKAQLLPVD SEHNAIFQSL PQPIQHNLGY ADLEQNGVVS ILLTGSGGPF RETPLRDLAT MTPDQACRHP NWSMGRKISV DSATMMNKGL EYIEARWLFN ASASQMEVLI HPQSVIHSMV RYQDGSVLAQ LGEPDMRTPI AHTMAWPNRV NSGVKPLDFC KLSALTFAAP DYDRYPCLKL AMEAFEQGQA ATTALNAANE ITVAAFLAQQ IRFTDIAALN LSVLEKMDMR EPQCVDDVLS VDANAREVAR KEVMRLAS // ID 1T1SB STANDARD; PRT; 398 AA. DT CONVERTED FROM PDB (SEQRES) 1T1S DE 1-deoxy-D-xylulose 5-phosphate reductoisomerase OS Escherichia coli CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.400 CC R-Factor 0.213 FT #SUB 158 157 GLN B 266 265 SER A Protein S 5 FT #SUB 158 157 GLN B 268 267 LEU A Protein S 1 FT #SUB 162 161 GLN B 162 161 GLN A Protein S 10 FT #SUB 176 175 ASN B 289 288 ARG A Protein B 1 FT #SUB 177 176 GLY B 289 288 ARG A Protein B 2 FT #SUB 182 181 LEU B 299 298 PHE A Protein S 1 FT #SUB 249 248 LEU B 299 298 PHE A Protein S 2 FT #SUB 259 258 MET B 299 298 PHE A Protein S 6 FT #SUB 261 260 ARG B 296 295 PRO A Protein S 5 FT #SUB 261 260 ARG B 297 296 LEU A Protein S 6 FT #SUB 262 261 TYR B 289 288 ARG A Protein S 9 FT #SUB 263 262 GLN B 289 288 ARG A Protein S 2 FT #SUB 263 262 GLN B 290 289 VAL A Protein A 11 FT #SUB 263 262 GLN B 291 290 ASN A Protein A 5 FT #SUB 264 263 ASP B 278 277 THR A Protein A 8 FT #SUB 264 263 ASP B 281 280 ALA A Protein S 1 FT #SUB 264 263 ASP B 282 281 HIS A Protein S 3 FT #SUB 264 263 ASP B 289 288 ARG A Protein S 5 FT #SUB 264 263 ASP B 290 289 VAL A Protein A 3 FT #SUB 264 263 ASP B 292 291 SER A Protein A 5 FT #SUB 266 265 SER B 158 157 GLN A Protein S 4 FT #SUB 266 265 SER B 270 269 GLN A Protein A 3 FT #SUB 266 265 SER B 271 270 LEU A Protein B 2 FT #SUB 266 265 SER B 278 277 THR A Protein A 2 FT #SUB 266 265 SER B 289 288 ARG A Protein S 2 FT #SUB 267 266 VAL B 269 268 ALA A Protein B 1 FT #SUB 267 266 VAL B 270 269 GLN A Protein B 2 FT #SUB 267 266 VAL B 271 270 LEU A Protein A 10 FT #SUB 267 266 VAL B 297 296 LEU A Protein S 1 FT #SUB 267 266 VAL B 299 298 PHE A Protein S 1 FT #SUB 268 267 LEU B 158 157 GLN A Protein S 2 FT #SUB 268 267 LEU B 269 268 ALA A Protein A 4 FT #SUB 268 267 LEU B 270 269 GLN A Protein S 3 FT #SUB 269 268 ALA B 267 266 VAL A Protein B 1 FT #SUB 269 268 ALA B 268 267 LEU A Protein B 2 FT #SUB 269 268 ALA B 269 268 ALA A Protein B 7 FT #SUB 270 269 GLN B 266 265 SER A Protein S 3 FT #SUB 270 269 GLN B 267 266 VAL A Protein B 2 FT #SUB 270 269 GLN B 268 267 LEU A Protein S 2 FT #SUB 271 270 LEU B 265 264 GLY A Protein B 1 FT #SUB 271 270 LEU B 266 265 SER A Protein B 2 FT #SUB 271 270 LEU B 267 266 VAL A Protein A 9 FT #SUB 278 277 THR B 264 263 ASP A Protein A 6 FT #SUB 278 277 THR B 266 265 SER A Protein S 2 FT #SUB 281 280 ALA B 264 263 ASP A Protein S 1 FT #SUB 282 281 HIS B 264 263 ASP A Protein A 2 FT #SUB 289 288 ARG B 177 176 GLY A Protein S 2 FT #SUB 289 288 ARG B 262 261 TYR A Protein S 12 FT #SUB 289 288 ARG B 263 262 GLN A Protein B 2 FT #SUB 289 288 ARG B 264 263 ASP A Protein S 2 FT #SUB 290 289 VAL B 263 262 GLN A Protein B 9 FT #SUB 290 289 VAL B 264 263 ASP A Protein B 3 FT #SUB 291 290 ASN B 263 262 GLN A Protein B 5 FT #SUB 292 291 SER B 264 263 ASP A Protein S 6 FT #SUB 294 293 VAL B 264 263 ASP A Protein S 1 FT #SUB 296 295 PRO B 261 260 ARG A Protein S 2 FT #SUB 297 296 LEU B 261 260 ARG A Protein B 3 FT #SUB 299 298 PHE B 182 181 LEU A Protein S 1 FT #SUB 299 298 PHE B 249 248 LEU A Protein S 2 FT #SUB 299 298 PHE B 259 258 MET A Protein S 6 FT #SUB 299 298 PHE B 261 260 ARG A Protein S 2 FT #SUB 299 298 PHE B 267 266 VAL A Protein S 1 FT #SUB 299 298 PHE B 307 306 PHE A Protein A 7 FT #SUB 300 299 CYS B 308 307 ALA A Protein S 1 FT #SUB 300 299 CYS B 309 308 ALA A Protein S 2 FT #SUB 304 303 ALA B 304 303 ALA A Protein S 1 FT #SUB 304 303 ALA B 305 304 LEU A Protein A 3 FT #SUB 304 303 ALA B 306 305 THR A Protein S 1 FT #SUB 305 304 LEU B 304 303 ALA A Protein B 2 FT #SUB 305 304 LEU B 305 304 LEU A Protein A 11 FT #SUB 306 305 THR B 304 303 ALA A Protein S 1 FT #SUB 307 306 PHE B 299 298 PHE A Protein S 8 FT #SUB 308 307 ALA B 300 299 CYS A Protein B 1 FT #SUB 309 308 ALA B 300 299 CYS A Protein A 2 FT #HET 125 124 LYS B 5 3001 CBQ B S 3 FT #HET 150 149 ASP B 5 3001 CBQ B A 6 FT #HET 151 150 SER B 5 3001 CBQ B A 13 FT #HET 152 151 GLU B 5 3001 CBQ B S 14 FT #HET 185 184 GLY B 4 1002 SO4 B B 2 FT #HET 186 185 SER B 4 1002 SO4 B A 8 FT #HET 209 208 HIS B 4 1002 SO4 B S 4 FT #HET 212 211 TRP B 4 1002 SO4 B S 3 FT #HET 212 211 TRP B 5 3001 CBQ B S 13 FT #HET 214 213 MET B 5 3001 CBQ B S 3 FT #HET 222 221 SER B 4 1002 SO4 B A 5 FT #HET 227 226 ASN B 4 1002 SO4 B S 5 FT #HET 227 226 ASN B 5 3001 CBQ B S 3 FT #HET 228 227 LYS B 4 1002 SO4 B S 5 FT #HET 231 230 GLU B 5 3001 CBQ B S 4 FT #HET 257 256 HIS B 5 3001 CBQ B S 2 FT #HET 274 273 PRO B 5 3001 CBQ B A 2 FT #HET 276 275 MET B 5 3001 CBQ B S 1 CC SEQUENCE 398 AA (ATOM); CC GKQLTILGST GSIGCSTLDV VRHNPEHFRV VALVAGKNVT RMVEQCLEFS PRYAVMDDEA CC SAKLLKTMLQ QQGSRTEVLS GQQAACDMAA LEDVDQVMAA IVGAAGLLPT LAAIRAGKTI CC LLANKESLVT CGRLFMDAVK QSKAQLLPVD SEHNAIFQSL PQPIQHNLGY ADLEQNGVVS CC ILLTGSGGPF RETPLRDLAT MTPDQACRHP NWSMGRKISV DSATMMNKGL EYIEARWLFN CC ASASQMEVLI HPQSVIHSMV RYQDGSVLAQ LGEPDMRTPI AHTMAWPNRV NSGVKPLDFC CC KLSALTFAAP DYDRYPCLKL AMEAFEQGQA ATTALNAANE ITVAAFLAQQ IRFTDIAALN CC LSVLEKMDMR EPQCVDDVLS VDANAREVAR KEVMRLAS CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GKQLTILGSTGSIGCSTLDVVRHNPEHFRVVALVAGKNVTRMVEQCLEFS CC ATOM GKQLTILGSTGSIGCSTLDVVRHNPEHFRVVALVAGKNVTRMVEQCLEFS CC ************************************************** CC SEQRES PRYAVMDDEASAKLLKTMLQQQGSRTEVLSGQQAACDMAALEDVDQVMAA CC ATOM PRYAVMDDEASAKLLKTMLQQQGSRTEVLSGQQAACDMAALEDVDQVMAA CC ************************************************** CC SEQRES IVGAAGLLPTLAAIRAGKTILLANKESLVTCGRLFMDAVKQSKAQLLPVD CC ATOM IVGAAGLLPTLAAIRAGKTILLANKESLVTCGRLFMDAVKQSKAQLLPVD CC ************************************************** CC SEQRES SEHNAIFQSLPQPIQHNLGYADLEQNGVVSILLTGSGGPFRETPLRDLAT CC ATOM SEHNAIFQSLPQPIQHNLGYADLEQNGVVSILLTGSGGPFRETPLRDLAT CC ************************************************** CC SEQRES MTPDQACRHPNWSMGRKISVDSATMMNKGLEYIEARWLFNASASQMEVLI CC ATOM MTPDQACRHPNWSMGRKISVDSATMMNKGLEYIEARWLFNASASQMEVLI CC ************************************************** CC SEQRES HPQSVIHSMVRYQDGSVLAQLGEPDMRTPIAHTMAWPNRVNSGVKPLDFC CC ATOM HPQSVIHSMVRYQDGSVLAQLGEPDMRTPIAHTMAWPNRVNSGVKPLDFC CC ************************************************** CC SEQRES KLSALTFAAPDYDRYPCLKLAMEAFEQGQAATTALNAANEITVAAFLAQQ CC ATOM KLSALTFAAPDYDRYPCLKLAMEAFEQGQAATTALNAANEITVAAFLAQQ CC ************************************************** CC SEQRES IRFTDIAALNLSVLEKMDMREPQCVDDVLSVDANAREVARKEVMRLAS CC ATOM IRFTDIAALNLSVLEKMDMREPQCVDDVLSVDANAREVARKEVMRLAS CC ************************************************ SQ SEQUENCE 398 AA; MW; CN; GKQLTILGST GSIGCSTLDV VRHNPEHFRV VALVAGKNVT RMVEQCLEFS PRYAVMDDEA SAKLLKTMLQ QQGSRTEVLS GQQAACDMAA LEDVDQVMAA IVGAAGLLPT LAAIRAGKTI LLANKESLVT CGRLFMDAVK QSKAQLLPVD SEHNAIFQSL PQPIQHNLGY ADLEQNGVVS ILLTGSGGPF RETPLRDLAT MTPDQACRHP NWSMGRKISV DSATMMNKGL EYIEARWLFN ASASQMEVLI HPQSVIHSMV RYQDGSVLAQ LGEPDMRTPI AHTMAWPNRV NSGVKPLDFC KLSALTFAAP DYDRYPCLKL AMEAFEQGQA ATTALNAANE ITVAAFLAQQ IRFTDIAALN LSVLEKMDMR EPQCVDDVLS VDANAREVAR KEVMRLAS //