ID 3UPPA STANDARD; PRT; 462 AA. DT CONVERTED FROM PDB (SEQRES) 3UPP DE Penicillin-binding protein A OS Mycobacterium tuberculosis CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.400 CC R-Factor 0.203 FT #SUB 126 155 TYR A 126 155 TYR B Protein S 4 FT #SUB 382 411 GLN A 126 155 TYR B Protein S 5 FT #SUB 382 411 GLN A 127 156 GLY B Protein S 1 FT #SUB 384 413 LYS A 126 155 TYR B Protein S 3 FT #SUB 409 438 PRO A 438 467 LEU B Protein S 2 FT #SUB 436 465 ASP A 438 467 LEU B Protein B 5 FT #SUB 437 466 ARG A 436 465 ASP B Protein A 11 FT #SUB 437 466 ARG A 439 468 SER B Protein S 3 FT #SUB 437 466 ARG A 441 470 THR B Protein S 1 FT #SUB 438 467 LEU A 436 465 ASP B Protein B 6 FT #SUB 438 467 LEU A 438 467 LEU B Protein S 1 FT #SUB 439 468 SER A 436 465 ASP B Protein A 6 FT #SUB 444 473 ALA A 126 155 TYR B Protein A 3 FT #HET 192 221 GLY A 1 800 CEF A B 2 FT #HET 193 222 SER A 1 800 CEF A A 15 FT #HET 196 225 LYS A 1 800 CEF A S 2 FT #HET 232 261 TYR A 1 800 CEF A S 6 FT #HET 251 280 LYS A 1 800 CEF A B 1 FT #HET 252 281 SER A 1 800 CEF A A 10 FT #HET 254 283 ASN A 1 800 CEF A S 7 FT #HET 308 337 ILE A 1 800 CEF A B 1 FT #HET 310 339 GLN A 1 800 CEF A S 4 FT #HET 395 424 LYS A 1 800 CEF A S 1 FT #HET 396 425 THR A 1 800 CEF A A 8 FT #HET 397 426 GLY A 1 800 CEF A B 3 FT #HET 398 427 THR A 1 800 CEF A A 20 FT #HET 400 429 GLU A 1 800 CEF A S 1 FT #HET 441 470 THR A 1 800 CEF A S 1 FT DISORDER 1 14 FT DISORDER 460 462 CC SEQUENCE 445 AA (ATOM); CC LLDEYSRQRG QITAGGQLLA YSVATDGRFR FLRVYPNPEV YAPVTGFYSL RYSSTALERA CC EDPILNGSDR RLFGRRLADF FTGRDPRGGN VDTTINPRIQ QAGWDAMQQG CYGPCKGAVV CC ALEPSTGKIL ALVSSPSYDP NLLASHNPEV QAQAWQRLGD NPASPLTNRA ISETYPPGST CC FKVITTAAAL AAGATETEQL TAAPTIPLPG STAQLENYGG APCGDEPTVS LREAFVKSCN CC TAFVQLGIRT GADALRSMAR AFGLDSPPRP TPLQVAESTV GPIPDSAALG MTSIGQKDVA CC LTPLANAEIA ATIANGGITM RPYLVGSLKG PDLANISTTV RYQQRRAVSP QVAAKLTELM CC VGAEKVAQQK GAIPGVQIAS KTGTAEHGTD PRHTPPHAWY IAFAPAQAPK VAVAVLVENG CC ADRLSATGGA LAAPIGRAVI EAALQ CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GAMGSRADPRNQRVLLDEYSRQRGQITAGGQLLAYSVATDGRFRFLRVYP CC ATOM --------------LLDEYSRQRGQITAGGQLLAYSVATDGRFRFLRVYP CC ************************************ CC SEQRES NPEVYAPVTGFYSLRYSSTALERAEDPILNGSDRRLFGRRLADFFTGRDP CC ATOM NPEVYAPVTGFYSLRYSSTALERAEDPILNGSDRRLFGRRLADFFTGRDP CC ************************************************** CC SEQRES RGGNVDTTINPRIQQAGWDAMQQGCYGPCKGAVVALEPSTGKILALVSSP CC ATOM RGGNVDTTINPRIQQAGWDAMQQGCYGPCKGAVVALEPSTGKILALVSSP CC ************************************************** CC SEQRES SYDPNLLASHNPEVQAQAWQRLGDNPASPLTNRAISETYPPGSTFKVITT CC ATOM SYDPNLLASHNPEVQAQAWQRLGDNPASPLTNRAISETYPPGSTFKVITT CC ************************************************** CC SEQRES AAALAAGATETEQLTAAPTIPLPGSTAQLENYGGAPCGDEPTVSLREAFV CC ATOM AAALAAGATETEQLTAAPTIPLPGSTAQLENYGGAPCGDEPTVSLREAFV CC ************************************************** CC SEQRES KSCNTAFVQLGIRTGADALRSMARAFGLDSPPRPTPLQVAESTVGPIPDS CC ATOM KSCNTAFVQLGIRTGADALRSMARAFGLDSPPRPTPLQVAESTVGPIPDS CC ************************************************** CC SEQRES AALGMTSIGQKDVALTPLANAEIAATIANGGITMRPYLVGSLKGPDLANI CC ATOM AALGMTSIGQKDVALTPLANAEIAATIANGGITMRPYLVGSLKGPDLANI CC ************************************************** CC SEQRES STTVRYQQRRAVSPQVAAKLTELMVGAEKVAQQKGAIPGVQIASKTGTAE CC ATOM STTVRYQQRRAVSPQVAAKLTELMVGAEKVAQQKGAIPGVQIASKTGTAE CC ************************************************** CC SEQRES HGTDPRHTPPHAWYIAFAPAQAPKVAVAVLVENGADRLSATGGALAAPIG CC ATOM HGTDPRHTPPHAWYIAFAPAQAPKVAVAVLVENGADRLSATGGALAAPIG CC ************************************************** CC SEQRES RAVIEAALQGEP CC ATOM RAVIEAALQ--- CC ********* SQ SEQUENCE 462 AA; MW; CN; GAMGSRADPR NQRVLLDEYS RQRGQITAGG QLLAYSVATD GRFRFLRVYP NPEVYAPVTG FYSLRYSSTA LERAEDPILN GSDRRLFGRR LADFFTGRDP RGGNVDTTIN PRIQQAGWDA MQQGCYGPCK GAVVALEPST GKILALVSSP SYDPNLLASH NPEVQAQAWQ RLGDNPASPL TNRAISETYP PGSTFKVITT AAALAAGATE TEQLTAAPTI PLPGSTAQLE NYGGAPCGDE PTVSLREAFV KSCNTAFVQL GIRTGADALR SMARAFGLDS PPRPTPLQVA ESTVGPIPDS AALGMTSIGQ KDVALTPLAN AEIAATIANG GITMRPYLVG SLKGPDLANI STTVRYQQRR AVSPQVAAKL TELMVGAEKV AQQKGAIPGV QIASKTGTAE HGTDPRHTPP HAWYIAFAPA QAPKVAVAVL VENGADRLSA TGGALAAPIG RAVIEAALQG EP // ID 3UPPB STANDARD; PRT; 462 AA. DT CONVERTED FROM PDB (SEQRES) 3UPP DE Penicillin-binding protein A OS Mycobacterium tuberculosis CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.400 CC R-Factor 0.203 FT #SUB 126 155 TYR B 126 155 TYR A Protein S 4 FT #SUB 126 155 TYR B 382 411 GLN A Protein B 5 FT #SUB 126 155 TYR B 384 413 LYS A Protein S 3 FT #SUB 126 155 TYR B 444 473 ALA A Protein S 3 FT #SUB 127 156 GLY B 382 411 GLN A Protein B 1 FT #SUB 436 465 ASP B 437 466 ARG A Protein S 11 FT #SUB 436 465 ASP B 438 467 LEU A Protein S 6 FT #SUB 436 465 ASP B 439 468 SER A Protein S 6 FT #SUB 438 467 LEU B 409 438 PRO A Protein S 2 FT #SUB 438 467 LEU B 436 465 ASP A Protein A 5 FT #SUB 438 467 LEU B 438 467 LEU A Protein S 1 FT #SUB 439 468 SER B 437 466 ARG A Protein S 3 FT #SUB 441 470 THR B 437 466 ARG A Protein S 1 FT #HET 193 222 SER B 2 800 CEF B A 14 FT #HET 232 261 TYR B 2 800 CEF B S 12 FT #HET 252 281 SER B 2 800 CEF B A 5 FT #HET 254 283 ASN B 2 800 CEF B S 6 FT #HET 310 339 GLN B 2 800 CEF B S 1 FT #HET 396 425 THR B 2 800 CEF B A 6 FT #HET 397 426 GLY B 2 800 CEF B B 6 FT #HET 398 427 THR B 2 800 CEF B A 16 FT #HET 400 429 GLU B 2 800 CEF B A 6 FT #HET 436 465 ASP B 2 800 CEF B B 1 FT #HET 439 468 SER B 2 800 CEF B B 3 FT #HET 440 469 ALA B 2 800 CEF B B 3 FT #HET 442 471 GLY B 2 800 CEF B B 6 FT #HET 443 472 GLY B 2 800 CEF B B 2 FT DISORDER 1 20 FT DISORDER 460 462 CC SEQUENCE 439 AA (ATOM); CC RQRGQITAGG QLLAYSVATD GRFRFLRVYP NPEVYAPVTG FYSLRYSSTA LERAEDPILN CC GSDRRLFGRR LADFFTGRDP RGGNVDTTIN PRIQQAGWDA MQQGCYGPCK GAVVALEPST CC GKILALVSSP SYDPNLLASH NPEVQAQAWQ RLGDNPASPL TNRAISETYP PGSTFKVITT CC AAALAAGATE TEQLTAAPTI PLPGSTAQLE NYGGAPCGDE PTVSLREAFV KSCNTAFVQL CC GIRTGADALR SMARAFGLDS PPRPTPLQVA ESTVGPIPDS AALGMTSIGQ KDVALTPLAN CC AEIAATIANG GITMRPYLVG SLKGPDLANI STTVRYQQRR AVSPQVAAKL TELMVGAEKV CC AQQKGAIPGV QIASKTGTAE HGTDPRHTPP HAWYIAFAPA QAPKVAVAVL VENGADRLSA CC TGGALAAPIG RAVIEAALQ CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES GAMGSRADPRNQRVLLDEYSRQRGQITAGGQLLAYSVATDGRFRFLRVYP CC ATOM --------------------RQRGQITAGGQLLAYSVATDGRFRFLRVYP CC ****************************** CC SEQRES NPEVYAPVTGFYSLRYSSTALERAEDPILNGSDRRLFGRRLADFFTGRDP CC ATOM NPEVYAPVTGFYSLRYSSTALERAEDPILNGSDRRLFGRRLADFFTGRDP CC ************************************************** CC SEQRES RGGNVDTTINPRIQQAGWDAMQQGCYGPCKGAVVALEPSTGKILALVSSP CC ATOM RGGNVDTTINPRIQQAGWDAMQQGCYGPCKGAVVALEPSTGKILALVSSP CC ************************************************** CC SEQRES SYDPNLLASHNPEVQAQAWQRLGDNPASPLTNRAISETYPPGSTFKVITT CC ATOM SYDPNLLASHNPEVQAQAWQRLGDNPASPLTNRAISETYPPGSTFKVITT CC ************************************************** CC SEQRES AAALAAGATETEQLTAAPTIPLPGSTAQLENYGGAPCGDEPTVSLREAFV CC ATOM AAALAAGATETEQLTAAPTIPLPGSTAQLENYGGAPCGDEPTVSLREAFV CC ************************************************** CC SEQRES KSCNTAFVQLGIRTGADALRSMARAFGLDSPPRPTPLQVAESTVGPIPDS CC ATOM KSCNTAFVQLGIRTGADALRSMARAFGLDSPPRPTPLQVAESTVGPIPDS CC ************************************************** CC SEQRES AALGMTSIGQKDVALTPLANAEIAATIANGGITMRPYLVGSLKGPDLANI CC ATOM AALGMTSIGQKDVALTPLANAEIAATIANGGITMRPYLVGSLKGPDLANI CC ************************************************** CC SEQRES STTVRYQQRRAVSPQVAAKLTELMVGAEKVAQQKGAIPGVQIASKTGTAE CC ATOM STTVRYQQRRAVSPQVAAKLTELMVGAEKVAQQKGAIPGVQIASKTGTAE CC ************************************************** CC SEQRES HGTDPRHTPPHAWYIAFAPAQAPKVAVAVLVENGADRLSATGGALAAPIG CC ATOM HGTDPRHTPPHAWYIAFAPAQAPKVAVAVLVENGADRLSATGGALAAPIG CC ************************************************** CC SEQRES RAVIEAALQGEP CC ATOM RAVIEAALQ--- CC ********* SQ SEQUENCE 462 AA; MW; CN; GAMGSRADPR NQRVLLDEYS RQRGQITAGG QLLAYSVATD GRFRFLRVYP NPEVYAPVTG FYSLRYSSTA LERAEDPILN GSDRRLFGRR LADFFTGRDP RGGNVDTTIN PRIQQAGWDA MQQGCYGPCK GAVVALEPST GKILALVSSP SYDPNLLASH NPEVQAQAWQ RLGDNPASPL TNRAISETYP PGSTFKVITT AAALAAGATE TEQLTAAPTI PLPGSTAQLE NYGGAPCGDE PTVSLREAFV KSCNTAFVQL GIRTGADALR SMARAFGLDS PPRPTPLQVA ESTVGPIPDS AALGMTSIGQ KDVALTPLAN AEIAATIANG GITMRPYLVG SLKGPDLANI STTVRYQQRR AVSPQVAAKL TELMVGAEKV AQQKGAIPGV QIASKTGTAE HGTDPRHTPP HAWYIAFAPA QAPKVAVAVL VENGADRLSA TGGALAAPIG RAVIEAALQG EP //