ID 4HNCA STANDARD; PRT; 383 AA. DT CONVERTED FROM PDB (SEQRES) 4HNC DE Mandelate racemase OS Pseudomonas putida CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.890 CC R-Factor 0.171 FT #SUB 78 54 TYR A 117 93 LEU B Protein S 6 FT #SUB 78 54 TYR A 118 94 ALA B Protein S 6 FT #SUB 81 57 VAL A 89 65 LEU B Protein B 1 FT #SUB 81 57 VAL A 92 68 ASP B Protein A 4 FT #SUB 81 57 VAL A 93 69 MET B Protein S 1 FT #SUB 81 57 VAL A 115 91 PHE B Protein S 1 FT #SUB 84 60 LYS A 88 64 GLN B Protein A 5 FT #SUB 84 60 LYS A 92 68 ASP B Protein S 1 FT #SUB 85 61 SER A 85 61 SER B Protein A 10 FT #SUB 85 61 SER A 88 64 GLN B Protein B 2 FT #SUB 85 61 SER A 89 65 LEU B Protein S 4 FT #SUB 88 64 GLN A 84 60 LYS B Protein S 5 FT #SUB 88 64 GLN A 85 61 SER B Protein S 1 FT #SUB 89 65 LEU A 81 57 VAL B Protein S 1 FT #SUB 89 65 LEU A 85 61 SER B Protein A 4 FT #SUB 89 65 LEU A 123 99 LEU B Protein S 1 FT #SUB 92 68 ASP A 81 57 VAL B Protein A 5 FT #SUB 92 68 ASP A 84 60 LYS B Protein S 1 FT #SUB 93 69 MET A 81 57 VAL B Protein S 1 FT #SUB 96 72 MET A 81 57 VAL B Protein S 1 FT #SUB 115 91 PHE A 81 57 VAL B Protein S 1 FT #SUB 116 92 SER A 222 198 GLN B Protein B 3 FT #SUB 117 93 LEU A 78 54 TYR B Protein A 6 FT #SUB 117 93 LEU A 221 197 ASN B Protein S 3 FT #SUB 117 93 LEU A 272 248 ASN B Protein B 1 FT #SUB 117 93 LEU A 297 273 LYS B Protein B 3 FT #SUB 118 94 ALA A 78 54 TYR B Protein A 7 FT #SUB 118 94 ALA A 297 273 LYS B Protein B 3 FT #SUB 119 95 GLY A 297 273 LYS B Protein B 1 FT #SUB 121 97 THR A 121 97 THR B Protein S 2 FT #SUB 121 97 THR A 122 98 GLY B Protein S 2 FT #SUB 121 97 THR A 274 250 LEU B Protein S 1 FT #SUB 122 98 GLY A 121 97 THR B Protein B 2 FT #SUB 221 197 ASN A 117 93 LEU B Protein S 3 FT #SUB 222 198 GLN A 116 92 SER B Protein S 3 FT #SUB 251 227 HIS A 277 253 GLU B Protein S 3 FT #SUB 251 227 HIS A 281 257 LYS B Protein A 4 FT #SUB 253 229 TYR A 281 257 LYS B Protein S 2 FT #SUB 272 248 ASN A 117 93 LEU B Protein S 1 FT #SUB 274 250 LEU A 121 97 THR B Protein S 1 FT #SUB 277 253 GLU A 251 227 HIS B Protein S 2 FT #SUB 281 257 LYS A 251 227 HIS B Protein S 4 FT #SUB 281 257 LYS A 253 229 TYR B Protein S 2 FT #SUB 297 273 LYS A 117 93 LEU B Protein S 3 FT #SUB 297 273 LYS A 118 94 ALA B Protein S 3 FT #SUB 297 273 LYS A 119 95 GLY B Protein S 1 FT #HET 76 52 PHE A 2 402 0UT A S 2 FT #HET 78 54 TYR A 2 402 0UT A S 2 FT #HET 164 140 HIS A 2 402 0UT A B 2 FT #HET 188 164 LYS A 1 401 MG A S 1 FT #HET 188 164 LYS A 2 402 0UT A S 4 FT #HET 190 166 CYS A 2 402 0UT A S 4 FT #HET 219 195 ASP A 1 401 MG A S 3 FT #HET 219 195 ASP A 2 402 0UT A S 7 FT #HET 221 197 ASN A 2 402 0UT A S 6 FT #HET 245 221 GLU A 1 401 MG A S 3 FT #HET 245 221 GLU A 2 402 0UT A S 2 FT #HET 271 247 GLU A 1 401 MG A S 3 FT #HET 271 247 GLU A 2 402 0UT A S 11 FT #HET 292 268 MET A 2 402 0UT A S 1 FT #HET 321 297 HIS A 2 402 0UT A S 10 FT #HET 322 298 LEU A 2 402 0UT A S 2 FT #HET 341 317 GLU A 2 402 0UT A S 5 FT #HET 343 319 LEU A 2 402 0UT A S 2 FT DISORDER 1 26 CC SEQUENCE 357 AA (ATOM); CC EVLITGLRTR AVNVPLAYPV HTAVGTVGTA PLVLIDLATS AGVVGHSYLF AYTPVALKSL CC KQLLDDMAAM IVNEPLAPVS LEAMLAKRFS LAGYTGLIRM AAAGIDMAAW DALGKVHETP CC LVKLLGANAR PVQAYDSHSL DGVKLATERA VTAAELGFRA VKTCIGYPAL DQDLAVVRSI CC RQAVGDDFGI MVDYNQSLDV PAAIKRSQAL QQEGVTWIEE PTLQHDYEGH QRIQSKLNVP CC VQMGENWLGP EEMFKALSIG ASRLAMPDAM KIGGVTGWIR ASALAQQFGI PMSSHLFQEI CC SAHLLAATPT AHWLERLDLA GSVIEPTLTF EGGNAVIPDL PGVGIIWREK EIGKYLV CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MASWSHPQFEKGALEVLFQGPGYHMSEVLITGLRTRAVNVPLAYPVHTAV CC ATOM --------------------------EVLITGLRTRAVNVPLAYPVHTAV CC ************************ CC SEQRES GTVGTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNE CC ATOM GTVGTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNE CC ************************************************** CC SEQRES PLAPVSLEAMLAKRFSLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKL CC ATOM PLAPVSLEAMLAKRFSLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKL CC ************************************************** CC SEQRES LGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTCIGYPALDQDL CC ATOM LGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTCIGYPALDQDL CC ************************************************** CC SEQRES AVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQ CC ATOM AVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQ CC ************************************************** CC SEQRES HDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGASRLAMPDAMKIGG CC ATOM HDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGASRLAMPDAMKIGG CC ************************************************** CC SEQRES VTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVI CC ATOM VTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVI CC ************************************************** CC SEQRES EPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV CC ATOM EPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV CC ********************************* SQ SEQUENCE 383 AA; MW; CN; MASWSHPQFE KGALEVLFQG PGYHMSEVLI TGLRTRAVNV PLAYPVHTAV GTVGTAPLVL IDLATSAGVV GHSYLFAYTP VALKSLKQLL DDMAAMIVNE PLAPVSLEAM LAKRFSLAGY TGLIRMAAAG IDMAAWDALG KVHETPLVKL LGANARPVQA YDSHSLDGVK LATERAVTAA ELGFRAVKTC IGYPALDQDL AVVRSIRQAV GDDFGIMVDY NQSLDVPAAI KRSQALQQEG VTWIEEPTLQ HDYEGHQRIQ SKLNVPVQMG ENWLGPEEMF KALSIGASRL AMPDAMKIGG VTGWIRASAL AQQFGIPMSS HLFQEISAHL LAATPTAHWL ERLDLAGSVI EPTLTFEGGN AVIPDLPGVG IIWREKEIGK YLV // ID 4HNCB STANDARD; PRT; 383 AA. DT CONVERTED FROM PDB (SEQRES) 4HNC DE Mandelate racemase OS Pseudomonas putida CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.890 CC R-Factor 0.171 FT #SUB 78 54 TYR B 117 93 LEU A Protein S 6 FT #SUB 78 54 TYR B 118 94 ALA A Protein S 7 FT #SUB 81 57 VAL B 89 65 LEU A Protein B 1 FT #SUB 81 57 VAL B 92 68 ASP A Protein A 5 FT #SUB 81 57 VAL B 93 69 MET A Protein S 1 FT #SUB 81 57 VAL B 96 72 MET A Protein S 1 FT #SUB 81 57 VAL B 115 91 PHE A Protein S 1 FT #SUB 84 60 LYS B 88 64 GLN A Protein A 5 FT #SUB 84 60 LYS B 92 68 ASP A Protein S 1 FT #SUB 85 61 SER B 85 61 SER A Protein A 10 FT #SUB 85 61 SER B 88 64 GLN A Protein B 1 FT #SUB 85 61 SER B 89 65 LEU A Protein S 4 FT #SUB 88 64 GLN B 84 60 LYS A Protein S 5 FT #SUB 88 64 GLN B 85 61 SER A Protein S 2 FT #SUB 89 65 LEU B 81 57 VAL A Protein S 1 FT #SUB 89 65 LEU B 85 61 SER A Protein A 4 FT #SUB 92 68 ASP B 81 57 VAL A Protein A 4 FT #SUB 92 68 ASP B 84 60 LYS A Protein S 1 FT #SUB 93 69 MET B 81 57 VAL A Protein S 1 FT #SUB 115 91 PHE B 81 57 VAL A Protein S 1 FT #SUB 116 92 SER B 222 198 GLN A Protein B 3 FT #SUB 117 93 LEU B 78 54 TYR A Protein A 6 FT #SUB 117 93 LEU B 221 197 ASN A Protein S 3 FT #SUB 117 93 LEU B 272 248 ASN A Protein B 1 FT #SUB 117 93 LEU B 297 273 LYS A Protein B 3 FT #SUB 118 94 ALA B 78 54 TYR A Protein A 6 FT #SUB 118 94 ALA B 297 273 LYS A Protein B 3 FT #SUB 119 95 GLY B 297 273 LYS A Protein B 1 FT #SUB 121 97 THR B 121 97 THR A Protein S 2 FT #SUB 121 97 THR B 122 98 GLY A Protein S 2 FT #SUB 121 97 THR B 274 250 LEU A Protein S 1 FT #SUB 122 98 GLY B 121 97 THR A Protein B 2 FT #SUB 123 99 LEU B 89 65 LEU A Protein S 1 FT #SUB 221 197 ASN B 117 93 LEU A Protein S 3 FT #SUB 222 198 GLN B 116 92 SER A Protein S 3 FT #SUB 251 227 HIS B 277 253 GLU A Protein S 2 FT #SUB 251 227 HIS B 281 257 LYS A Protein A 4 FT #SUB 253 229 TYR B 281 257 LYS A Protein S 2 FT #SUB 272 248 ASN B 117 93 LEU A Protein S 1 FT #SUB 274 250 LEU B 121 97 THR A Protein S 1 FT #SUB 277 253 GLU B 251 227 HIS A Protein S 3 FT #SUB 281 257 LYS B 251 227 HIS A Protein S 4 FT #SUB 281 257 LYS B 253 229 TYR A Protein S 2 FT #SUB 297 273 LYS B 117 93 LEU A Protein S 3 FT #SUB 297 273 LYS B 118 94 ALA A Protein S 3 FT #SUB 297 273 LYS B 119 95 GLY A Protein S 1 FT #HET 76 52 PHE B 4 402 0UT B S 1 FT #HET 164 140 HIS B 4 402 0UT B B 1 FT #HET 188 164 LYS B 3 401 MG B S 1 FT #HET 188 164 LYS B 4 402 0UT B S 4 FT #HET 190 166 CYS B 4 402 0UT B S 2 FT #HET 219 195 ASP B 3 401 MG B S 3 FT #HET 219 195 ASP B 4 402 0UT B S 6 FT #HET 221 197 ASN B 4 402 0UT B S 7 FT #HET 245 221 GLU B 3 401 MG B S 4 FT #HET 245 221 GLU B 4 402 0UT B S 3 FT #HET 271 247 GLU B 3 401 MG B S 3 FT #HET 271 247 GLU B 4 402 0UT B S 10 FT #HET 321 297 HIS B 4 402 0UT B S 10 FT #HET 341 317 GLU B 4 402 0UT B S 5 FT #HET 343 319 LEU B 4 402 0UT B S 1 FT DISORDER 1 26 FT DISORDER 48 53 CC SEQUENCE 351 AA (ATOM); CC EVLITGLRTR AVNVPLAYPV HGTAPLVLID LATSAGVVGH SYLFAYTPVA LKSLKQLLDD CC MAAMIVNEPL APVSLEAMLA KRFSLAGYTG LIRMAAAGID MAAWDALGKV HETPLVKLLG CC ANARPVQAYD SHSLDGVKLA TERAVTAAEL GFRAVKTCIG YPALDQDLAV VRSIRQAVGD CC DFGIMVDYNQ SLDVPAAIKR SQALQQEGVT WIEEPTLQHD YEGHQRIQSK LNVPVQMGEN CC WLGPEEMFKA LSIGASRLAM PDAMKIGGVT GWIRASALAQ QFGIPMSSHL FQEISAHLLA CC ATPTAHWLER LDLAGSVIEP TLTFEGGNAV IPDLPGVGII WREKEIGKYL V CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MASWSHPQFEKGALEVLFQGPGYHMSEVLITGLRTRAVNVPLAYPVHTAV CC ATOM --------------------------EVLITGLRTRAVNVPLAYPVH--- CC ********************* CC SEQRES GTVGTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNE CC ATOM ---GTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNE CC *********************************************** CC SEQRES PLAPVSLEAMLAKRFSLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKL CC ATOM PLAPVSLEAMLAKRFSLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKL CC ************************************************** CC SEQRES LGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTCIGYPALDQDL CC ATOM LGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTCIGYPALDQDL CC ************************************************** CC SEQRES AVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQ CC ATOM AVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQ CC ************************************************** CC SEQRES HDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGASRLAMPDAMKIGG CC ATOM HDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGASRLAMPDAMKIGG CC ************************************************** CC SEQRES VTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVI CC ATOM VTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVI CC ************************************************** CC SEQRES EPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV CC ATOM EPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV CC ********************************* SQ SEQUENCE 383 AA; MW; CN; MASWSHPQFE KGALEVLFQG PGYHMSEVLI TGLRTRAVNV PLAYPVHTAV GTVGTAPLVL IDLATSAGVV GHSYLFAYTP VALKSLKQLL DDMAAMIVNE PLAPVSLEAM LAKRFSLAGY TGLIRMAAAG IDMAAWDALG KVHETPLVKL LGANARPVQA YDSHSLDGVK LATERAVTAA ELGFRAVKTC IGYPALDQDL AVVRSIRQAV GDDFGIMVDY NQSLDVPAAI KRSQALQQEG VTWIEEPTLQ HDYEGHQRIQ SKLNVPVQMG ENWLGPEEMF KALSIGASRL AMPDAMKIGG VTGWIRASAL AQQFGIPMSS HLFQEISAHL LAATPTAHWL ERLDLAGSVI EPTLTFEGGN AVIPDLPGVG IIWREKEIGK YLV //