ID 4DDKA STANDARD; PRT; 301 AA. DT CONVERTED FROM PDB (SEQRES) 4DDK DE Pantothenate synthetase OS Mycobacterium tuberculosis CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.750 CC R-Factor 0.187 FT #SUB 25 25 ARG A 178 178 ASP B Protein S 4 FT #SUB 112 112 ASP A 174 174 ASP B Protein S 1 FT #SUB 115 115 ARG A 119 119 GLN B Protein B 1 FT #SUB 115 115 ARG A 121 121 GLY B Protein A 5 FT #SUB 115 115 ARG A 170 170 GLN B Protein S 16 FT #SUB 115 115 ARG A 174 174 ASP B Protein S 12 FT #SUB 116 116 THR A 118 118 VAL B Protein S 1 FT #SUB 116 116 THR A 119 119 GLN B Protein A 3 FT #SUB 116 116 THR A 170 170 GLN B Protein S 3 FT #SUB 116 116 THR A 171 171 LEU B Protein S 3 FT #SUB 116 116 THR A 174 174 ASP B Protein A 8 FT #SUB 116 116 THR A 175 175 PHE B Protein A 4 FT #SUB 117 117 THR A 118 118 VAL B Protein B 2 FT #SUB 117 117 THR A 119 119 GLN B Protein A 12 FT #SUB 117 117 THR A 175 175 PHE B Protein B 5 FT #SUB 118 118 VAL A 116 116 THR B Protein S 1 FT #SUB 118 118 VAL A 117 117 THR B Protein A 3 FT #SUB 118 118 VAL A 175 175 PHE B Protein S 1 FT #SUB 119 119 GLN A 115 115 ARG B Protein B 1 FT #SUB 119 119 GLN A 116 116 THR B Protein B 3 FT #SUB 119 119 GLN A 117 117 THR B Protein A 13 FT #SUB 119 119 GLN A 119 119 GLN B Protein S 1 FT #SUB 120 120 PRO A 115 115 ARG B Protein B 1 FT #SUB 121 121 GLY A 115 115 ARG B Protein B 5 FT #SUB 144 144 LEU A 175 175 PHE B Protein S 5 FT #SUB 145 145 LYS A 174 174 ASP B Protein S 4 FT #SUB 145 145 LYS A 176 176 ASN B Protein A 8 FT #SUB 148 148 GLN A 148 148 GLN B Protein S 7 FT #SUB 148 148 GLN A 175 175 PHE B Protein S 2 FT #SUB 148 148 GLN A 176 176 ASN B Protein A 4 FT #SUB 148 148 GLN A 177 177 LEU B Protein S 3 FT #SUB 149 149 ILE A 176 176 ASN B Protein S 4 FT #SUB 151 151 ARG A 151 151 ARG B Protein S 2 FT #SUB 151 151 ARG A 176 176 ASN B Protein S 1 FT #SUB 151 151 ARG A 177 177 LEU B Protein S 3 FT #SUB 151 151 ARG A 178 178 ASP B Protein S 10 FT #SUB 170 170 GLN A 115 115 ARG B Protein A 14 FT #SUB 170 170 GLN A 116 116 THR B Protein A 3 FT #SUB 171 171 LEU A 116 116 THR B Protein B 1 FT #SUB 173 173 ALA A 115 115 ARG B Protein S 1 FT #SUB 174 174 ASP A 115 115 ARG B Protein S 12 FT #SUB 174 174 ASP A 116 116 THR B Protein S 9 FT #SUB 174 174 ASP A 145 145 LYS B Protein B 5 FT #SUB 175 175 PHE A 116 116 THR B Protein S 3 FT #SUB 175 175 PHE A 117 117 THR B Protein S 5 FT #SUB 175 175 PHE A 118 118 VAL B Protein S 2 FT #SUB 175 175 PHE A 144 144 LEU B Protein S 3 FT #SUB 175 175 PHE A 148 148 GLN B Protein B 2 FT #SUB 176 176 ASN A 145 145 LYS B Protein S 6 FT #SUB 176 176 ASN A 148 148 GLN B Protein B 4 FT #SUB 176 176 ASN A 149 149 ILE B Protein S 5 FT #SUB 177 177 LEU A 148 148 GLN B Protein S 3 FT #SUB 178 178 ASP A 25 25 ARG B Protein S 5 FT #HET 38 38 PRO A 2 402 GOL A B 1 FT #HET 40 40 MET A 2 402 GOL A S 1 FT #HET 40 40 MET A 4 404 EOH A S 2 FT #HET 44 44 HIS A 1 401 0HN A S 9 FT #HET 46 46 GLY A 1 401 0HN A B 10 FT #HET 47 47 HIS A 1 401 0HN A S 3 FT #HET 50 50 LEU A 1 401 0HN A S 3 FT #HET 72 72 GLN A 2 402 GOL A S 7 FT #HET 72 72 GLN A 4 404 EOH A S 3 FT #HET 73 73 PHE A 4 404 EOH A S 2 FT #HET 109 109 MET A 3 403 GOL A B 1 FT #HET 110 110 TYR A 3 403 GOL A A 10 FT #HET 111 111 PRO A 3 403 GOL A A 2 FT #HET 112 112 ASP A 3 403 GOL A A 4 FT #HET 113 113 GLY A 3 403 GOL A B 7 FT #HET 114 114 LEU A 3 403 GOL A B 2 FT #HET 115 115 ARG A 3 403 GOL A A 5 FT #HET 116 116 THR A 3 403 GOL A B 4 FT #HET 135 135 HIS A 4 404 EOH A S 1 FT #HET 142 142 VAL A 2 402 GOL A S 1 FT #HET 145 145 LYS A 3 403 GOL A S 3 FT #HET 157 157 PHE A 2 402 GOL A S 1 FT #HET 158 158 GLY A 1 401 0HN A B 4 FT #HET 160 160 LYS A 1 401 0HN A S 1 FT #HET 164 164 GLN A 2 402 GOL A S 4 FT #HET 184 184 VAL A 1 401 0HN A A 2 FT #HET 185 185 PRO A 1 401 0HN A B 3 FT #HET 186 186 THR A 1 401 0HN A B 2 FT #HET 187 187 VAL A 1 401 0HN A A 5 FT #HET 195 195 MET A 1 401 0HN A B 3 FT #HET 196 196 SER A 1 401 0HN A B 1 FT DISORDER 1 2 FT DISORDER 292 301 CC SEQUENCE 289 AA (ATOM); CC IPAFHPGELN VYSAPGDVAD VSRALRLTGR RVMLVPTMGA LHEGHLALVR AAKRVPGSVV CC VVSIFVNPMQ FGAGGDLDAY PRTPDDDLAQ LRAEGVEIAF TPTTAAMYPD GLRTTVQPGP CC LAAELEGGPR PTHFAGVLTV VLKLLQIVRP DRVFFGEKDY QQLVLIRQLV ADFNLDVAVV CC GVPTVREADG LAMSSRNRYL DPAQRAAAVA LSAALTAAAH AATAGAQAAL DAARAVLDAA CC PGVAVDYLEL RDIGLGPMPL NGSGRLLVAA RLGTTRLLDN IAIEIGTFA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAIPAFHPGELNVYSAPGDVADVSRALRLTGRRVMLVPTMGALHEGHLAL CC ATOM --IPAFHPGELNVYSAPGDVADVSRALRLTGRRVMLVPTMGALHEGHLAL CC ************************************************ CC SEQRES VRAAKRVPGSVVVVSIFVNPMQFGAGGDLDAYPRTPDDDLAQLRAEGVEI CC ATOM VRAAKRVPGSVVVVSIFVNPMQFGAGGDLDAYPRTPDDDLAQLRAEGVEI CC ************************************************** CC SEQRES AFTPTTAAMYPDGLRTTVQPGPLAAELEGGPRPTHFAGVLTVVLKLLQIV CC ATOM AFTPTTAAMYPDGLRTTVQPGPLAAELEGGPRPTHFAGVLTVVLKLLQIV CC ************************************************** CC SEQRES RPDRVFFGEKDYQQLVLIRQLVADFNLDVAVVGVPTVREADGLAMSSRNR CC ATOM RPDRVFFGEKDYQQLVLIRQLVADFNLDVAVVGVPTVREADGLAMSSRNR CC ************************************************** CC SEQRES YLDPAQRAAAVALSAALTAAAHAATAGAQAALDAARAVLDAAPGVAVDYL CC ATOM YLDPAQRAAAVALSAALTAAAHAATAGAQAALDAARAVLDAAPGVAVDYL CC ************************************************** CC SEQRES ELRDIGLGPMPLNGSGRLLVAARLGTTRLLDNIAIEIGTFAGTDRPDGYR CC ATOM ELRDIGLGPMPLNGSGRLLVAARLGTTRLLDNIAIEIGTFA--------- CC ***************************************** CC SEQRES A CC ATOM - CC SQ SEQUENCE 301 AA; MW; CN; MAIPAFHPGE LNVYSAPGDV ADVSRALRLT GRRVMLVPTM GALHEGHLAL VRAAKRVPGS VVVVSIFVNP MQFGAGGDLD AYPRTPDDDL AQLRAEGVEI AFTPTTAAMY PDGLRTTVQP GPLAAELEGG PRPTHFAGVL TVVLKLLQIV RPDRVFFGEK DYQQLVLIRQ LVADFNLDVA VVGVPTVREA DGLAMSSRNR YLDPAQRAAA VALSAALTAA AHAATAGAQA ALDAARAVLD AAPGVAVDYL ELRDIGLGPM PLNGSGRLLV AARLGTTRLL DNIAIEIGTF AGTDRPDGYR A // ID 4DDKB STANDARD; PRT; 301 AA. DT CONVERTED FROM PDB (SEQRES) 4DDK DE Pantothenate synthetase OS Mycobacterium tuberculosis CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.750 CC R-Factor 0.187 FT #SUB 25 25 ARG B 178 178 ASP A Protein S 5 FT #SUB 115 115 ARG B 119 119 GLN A Protein B 1 FT #SUB 115 115 ARG B 120 120 PRO A Protein B 1 FT #SUB 115 115 ARG B 121 121 GLY A Protein A 5 FT #SUB 115 115 ARG B 170 170 GLN A Protein S 14 FT #SUB 115 115 ARG B 173 173 ALA A Protein S 1 FT #SUB 115 115 ARG B 174 174 ASP A Protein A 12 FT #SUB 116 116 THR B 118 118 VAL A Protein S 1 FT #SUB 116 116 THR B 119 119 GLN A Protein A 3 FT #SUB 116 116 THR B 170 170 GLN A Protein S 3 FT #SUB 116 116 THR B 171 171 LEU A Protein S 1 FT #SUB 116 116 THR B 174 174 ASP A Protein A 9 FT #SUB 116 116 THR B 175 175 PHE A Protein A 3 FT #SUB 117 117 THR B 118 118 VAL A Protein B 3 FT #SUB 117 117 THR B 119 119 GLN A Protein A 13 FT #SUB 117 117 THR B 175 175 PHE A Protein B 5 FT #SUB 118 118 VAL B 116 116 THR A Protein S 1 FT #SUB 118 118 VAL B 117 117 THR A Protein B 2 FT #SUB 118 118 VAL B 175 175 PHE A Protein A 2 FT #SUB 119 119 GLN B 115 115 ARG A Protein B 1 FT #SUB 119 119 GLN B 116 116 THR A Protein B 3 FT #SUB 119 119 GLN B 117 117 THR A Protein A 12 FT #SUB 119 119 GLN B 119 119 GLN A Protein S 1 FT #SUB 121 121 GLY B 115 115 ARG A Protein B 5 FT #SUB 144 144 LEU B 175 175 PHE A Protein S 3 FT #SUB 145 145 LYS B 174 174 ASP A Protein S 5 FT #SUB 145 145 LYS B 176 176 ASN A Protein A 6 FT #SUB 148 148 GLN B 148 148 GLN A Protein S 7 FT #SUB 148 148 GLN B 175 175 PHE A Protein S 2 FT #SUB 148 148 GLN B 176 176 ASN A Protein A 4 FT #SUB 148 148 GLN B 177 177 LEU A Protein S 3 FT #SUB 149 149 ILE B 176 176 ASN A Protein S 5 FT #SUB 151 151 ARG B 151 151 ARG A Protein S 2 FT #SUB 170 170 GLN B 115 115 ARG A Protein A 16 FT #SUB 170 170 GLN B 116 116 THR A Protein A 3 FT #SUB 171 171 LEU B 116 116 THR A Protein A 3 FT #SUB 174 174 ASP B 112 112 ASP A Protein S 1 FT #SUB 174 174 ASP B 115 115 ARG A Protein S 12 FT #SUB 174 174 ASP B 116 116 THR A Protein S 8 FT #SUB 174 174 ASP B 145 145 LYS A Protein B 4 FT #SUB 175 175 PHE B 116 116 THR A Protein S 4 FT #SUB 175 175 PHE B 117 117 THR A Protein S 5 FT #SUB 175 175 PHE B 118 118 VAL A Protein S 1 FT #SUB 175 175 PHE B 144 144 LEU A Protein S 5 FT #SUB 175 175 PHE B 148 148 GLN A Protein B 2 FT #SUB 176 176 ASN B 145 145 LYS A Protein S 8 FT #SUB 176 176 ASN B 148 148 GLN A Protein B 4 FT #SUB 176 176 ASN B 149 149 ILE A Protein S 4 FT #SUB 176 176 ASN B 151 151 ARG A Protein B 1 FT #SUB 177 177 LEU B 148 148 GLN A Protein S 3 FT #SUB 177 177 LEU B 151 151 ARG A Protein B 3 FT #SUB 178 178 ASP B 25 25 ARG A Protein S 4 FT #SUB 178 178 ASP B 151 151 ARG A Protein A 10 FT #HET 38 38 PRO B 7 403 GOL B B 1 FT #HET 40 40 MET B 7 403 GOL B S 1 FT #HET 44 44 HIS B 5 401 0HN B S 6 FT #HET 46 46 GLY B 5 401 0HN B B 12 FT #HET 47 47 HIS B 5 401 0HN B S 2 FT #HET 50 50 LEU B 5 401 0HN B S 4 FT #HET 56 56 ARG B 6 402 0HN B A 9 FT #HET 57 57 VAL B 6 402 0HN B S 1 FT #HET 58 58 PRO B 6 402 0HN B S 5 FT #HET 66 66 ILE B 9 405 EOH B B 1 FT #HET 67 67 PHE B 9 405 EOH B A 5 FT #HET 68 68 VAL B 9 405 EOH B B 2 FT #HET 72 72 GLN B 7 403 GOL B S 6 FT #HET 104 104 PRO B 9 405 EOH B B 2 FT #HET 139 139 VAL B 7 403 GOL B S 2 FT #HET 142 142 VAL B 7 403 GOL B S 1 FT #HET 154 154 ARG B 6 402 0HN B S 6 FT #HET 158 158 GLY B 5 401 0HN B B 3 FT #HET 160 160 LYS B 5 401 0HN B S 1 FT #HET 164 164 GLN B 7 403 GOL B S 5 FT #HET 174 174 ASP B 3 403 GOL A A 5 FT #HET 184 184 VAL B 5 401 0HN B B 1 FT #HET 185 185 PRO B 5 401 0HN B B 2 FT #HET 186 186 THR B 5 401 0HN B B 2 FT #HET 187 187 VAL B 5 401 0HN B A 3 FT #HET 195 195 MET B 5 401 0HN B B 1 FT #HET 208 208 ALA B 10 406 EDO B B 1 FT #HET 209 209 ALA B 10 406 EDO B B 1 FT #HET 212 212 ALA B 10 406 EDO B S 1 FT #HET 241 241 ALA B 10 406 EDO B A 3 FT #HET 242 242 ALA B 10 406 EDO B A 5 FT #HET 243 243 PRO B 10 406 EDO B S 1 FT #HET 244 244 GLY B 8 404 GOL B B 8 FT #HET 246 246 ALA B 8 404 GOL B S 2 FT #HET 273 273 ARG B 8 404 GOL B B 3 FT #HET 274 274 LEU B 8 404 GOL B B 5 FT #HET 275 275 GLY B 8 404 GOL B B 5 FT DISORDER 1 1 FT DISORDER 76 81 FT DISORDER 289 301 CC SEQUENCE 281 AA (ATOM); CC AIPAFHPGEL NVYSAPGDVA DVSRALRLTG RRVMLVPTMG ALHEGHLALV RAAKRVPGSV CC VVVSIFVNPM QFGAYPRTPD DDLAQLRAEG VEIAFTPTTA AMYPDGLRTT VQPGPLAAEL CC EGGPRPTHFA GVLTVVLKLL QIVRPDRVFF GEKDYQQLVL IRQLVADFNL DVAVVGVPTV CC READGLAMSS RNRYLDPAQR AAAVALSAAL TAAAHAATAG AQAALDAARA VLDAAPGVAV CC DYLELRDIGL GPMPLNGSGR LLVAARLGTT RLLDNIAIEI G CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MAIPAFHPGELNVYSAPGDVADVSRALRLTGRRVMLVPTMGALHEGHLAL CC ATOM -AIPAFHPGELNVYSAPGDVADVSRALRLTGRRVMLVPTMGALHEGHLAL CC ************************************************* CC SEQRES VRAAKRVPGSVVVVSIFVNPMQFGAGGDLDAYPRTPDDDLAQLRAEGVEI CC ATOM VRAAKRVPGSVVVVSIFVNPMQFGA------YPRTPDDDLAQLRAEGVEI CC ************************* ******************* CC SEQRES AFTPTTAAMYPDGLRTTVQPGPLAAELEGGPRPTHFAGVLTVVLKLLQIV CC ATOM AFTPTTAAMYPDGLRTTVQPGPLAAELEGGPRPTHFAGVLTVVLKLLQIV CC ************************************************** CC SEQRES RPDRVFFGEKDYQQLVLIRQLVADFNLDVAVVGVPTVREADGLAMSSRNR CC ATOM RPDRVFFGEKDYQQLVLIRQLVADFNLDVAVVGVPTVREADGLAMSSRNR CC ************************************************** CC SEQRES YLDPAQRAAAVALSAALTAAAHAATAGAQAALDAARAVLDAAPGVAVDYL CC ATOM YLDPAQRAAAVALSAALTAAAHAATAGAQAALDAARAVLDAAPGVAVDYL CC ************************************************** CC SEQRES ELRDIGLGPMPLNGSGRLLVAARLGTTRLLDNIAIEIGTFAGTDRPDGYR CC ATOM ELRDIGLGPMPLNGSGRLLVAARLGTTRLLDNIAIEIG------------ CC ************************************** CC SEQRES A CC ATOM - CC SQ SEQUENCE 301 AA; MW; CN; MAIPAFHPGE LNVYSAPGDV ADVSRALRLT GRRVMLVPTM GALHEGHLAL VRAAKRVPGS VVVVSIFVNP MQFGAGGDLD AYPRTPDDDL AQLRAEGVEI AFTPTTAAMY PDGLRTTVQP GPLAAELEGG PRPTHFAGVL TVVLKLLQIV RPDRVFFGEK DYQQLVLIRQ LVADFNLDVA VVGVPTVREA DGLAMSSRNR YLDPAQRAAA VALSAALTAA AHAATAGAQA ALDAARAVLD AAPGVAVDYL ELRDIGLGPM PLNGSGRLLV AARLGTTRLL DNIAIEIGTF AGTDRPDGYR A //