ID 2C6XA STANDARD; PRT; 363 AA. DT CONVERTED FROM PDB (SEQRES) 2C6X DE CITRATE SYNTHASE 1 OS BACILLUS SUBTILIS CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.400 CC R-Factor 0.284 FT #SUB 1 2 VAL A 9 10 THR B Protein A 2 FT #SUB 2 3 HIS A 9 10 THR B Protein B 1 FT #SUB 2 3 HIS A 10 11 CYS B Protein B 2 FT #SUB 3 4 TYR A 12 13 GLU B Protein S 3 FT #SUB 3 4 TYR A 347 348 MET B Protein A 3 FT #SUB 4 5 GLY A 347 348 MET B Protein B 1 FT #SUB 4 5 GLY A 348 349 ILE B Protein B 4 FT #SUB 4 5 GLY A 349 350 PHE B Protein B 6 FT #SUB 4 5 GLY A 350 351 ARG B Protein B 2 FT #SUB 5 6 LEU A 5 6 LEU B Protein S 1 FT #SUB 5 6 LEU A 8 9 ILE B Protein S 1 FT #SUB 5 6 LEU A 10 11 CYS B Protein S 6 FT #SUB 5 6 LEU A 350 351 ARG B Protein B 2 FT #SUB 5 6 LEU A 351 352 PRO B Protein B 1 FT #SUB 6 7 LYS A 348 349 ILE B Protein S 1 FT #SUB 6 7 LYS A 350 351 ARG B Protein B 2 FT #SUB 8 9 ILE A 5 6 LEU B Protein S 1 FT #SUB 8 9 ILE A 351 352 PRO B Protein B 3 FT #SUB 8 9 ILE A 352 353 SER B Protein B 6 FT #SUB 9 10 THR A 1 2 VAL B Protein B 2 FT #SUB 9 10 THR A 2 3 HIS B Protein B 1 FT #SUB 9 10 THR A 352 353 SER B Protein A 10 FT #SUB 9 10 THR A 353 354 ALA B Protein S 3 FT #SUB 9 10 THR A 354 355 GLN B Protein S 1 FT #SUB 10 11 CYS A 2 3 HIS B Protein A 2 FT #SUB 10 11 CYS A 5 6 LEU B Protein S 4 FT #SUB 10 11 CYS A 351 352 PRO B Protein S 2 FT #SUB 10 11 CYS A 352 353 SER B Protein B 1 FT #SUB 11 12 VAL A 352 353 SER B Protein B 1 FT #SUB 11 12 VAL A 353 354 ALA B Protein A 7 FT #SUB 11 12 VAL A 354 355 GLN B Protein B 5 FT #SUB 12 13 GLU A 3 4 TYR B Protein S 3 FT #SUB 12 13 GLU A 354 355 GLN B Protein A 3 FT #SUB 12 13 GLU A 356 357 THR B Protein S 1 FT #SUB 13 14 THR A 354 355 GLN B Protein B 4 FT #SUB 13 14 THR A 355 356 TYR B Protein B 5 FT #SUB 13 14 THR A 356 357 THR B Protein B 2 FT #SUB 14 15 SER A 355 356 TYR B Protein B 3 FT #SUB 14 15 SER A 356 357 THR B Protein S 1 FT #SUB 14 15 SER A 357 358 GLY B Protein S 1 FT #SUB 17 18 HIS A 355 356 TYR B Protein S 3 FT #SUB 24 25 ARG A 359 360 ILE B Protein S 1 FT #SUB 24 25 ARG A 362 363 GLU B Protein S 1 FT #SUB 26 27 ILE A 360 361 PRO B Protein S 2 FT #SUB 29 30 GLY A 355 356 TYR B Protein B 2 FT #SUB 29 30 GLY A 358 359 ALA B Protein B 1 FT #SUB 29 30 GLY A 360 361 PRO B Protein B 5 FT #SUB 31 32 HIS A 360 361 PRO B Protein S 1 FT #SUB 31 32 HIS A 362 363 GLU B Protein S 2 FT #SUB 84 85 PRO A 75 76 HIS B Protein S 3 FT #SUB 86 87 ASN A 102 103 GLU B Protein A 9 FT #SUB 86 87 ASN A 103 104 ASN B Protein A 8 FT #SUB 87 88 MET A 99 100 ALA B Protein S 2 FT #SUB 87 88 MET A 101 102 GLY B Protein S 3 FT #SUB 87 88 MET A 102 103 GLU B Protein S 1 FT #SUB 87 88 MET A 103 104 ASN B Protein B 1 FT #SUB 88 89 ASP A 102 103 GLU B Protein S 1 FT #SUB 91 92 SER A 101 102 GLY B Protein S 1 FT #SUB 91 92 SER A 102 103 GLU B Protein S 1 FT #SUB 94 95 ARG A 98 99 SER B Protein A 11 FT #SUB 94 95 ARG A 101 102 GLY B Protein S 1 FT #SUB 94 95 ARG A 195 196 ASP B Protein S 3 FT #SUB 94 95 ARG A 197 198 VAL B Protein S 1 FT #SUB 94 95 ARG A 198 199 SER B Protein S 3 FT #SUB 95 96 THR A 98 99 SER B Protein A 7 FT #SUB 95 96 THR A 99 100 ALA B Protein S 2 FT #SUB 98 99 SER A 94 95 ARG B Protein A 10 FT #SUB 98 99 SER A 95 96 THR B Protein A 8 FT #SUB 99 100 ALA A 87 88 MET B Protein B 1 FT #SUB 101 102 GLY A 87 88 MET B Protein B 3 FT #SUB 102 103 GLU A 86 87 ASN B Protein A 5 FT #SUB 102 103 GLU A 87 88 MET B Protein S 1 FT #SUB 102 103 GLU A 91 92 SER B Protein B 1 FT #SUB 102 103 GLU A 208 209 LYS B Protein B 1 FT #SUB 103 104 ASN A 86 87 ASN B Protein S 9 FT #SUB 103 104 ASN A 87 88 MET B Protein S 1 FT #SUB 105 106 TYR A 208 209 LYS B Protein B 1 FT #SUB 179 180 MET A 351 352 PRO B Protein A 4 FT #SUB 179 180 MET A 353 354 ALA B Protein S 1 FT #SUB 181 182 ALA A 192 193 THR B Protein S 1 FT #SUB 184 185 PHE A 351 352 PRO B Protein S 4 FT #SUB 185 186 SER A 189 190 THR B Protein S 1 FT #SUB 189 190 THR A 185 186 SER B Protein S 1 FT #SUB 189 190 THR A 206 207 THR B Protein A 6 FT #SUB 192 193 THR A 181 182 ALA B Protein S 1 FT #SUB 192 193 THR A 206 207 THR B Protein S 4 FT #SUB 192 193 THR A 209 210 GLY B Protein A 3 FT #SUB 192 193 THR A 210 211 PRO B Protein B 2 FT #SUB 192 193 THR A 211 212 LEU B Protein B 1 FT #SUB 193 194 GLU A 210 211 PRO B Protein A 5 FT #SUB 193 194 GLU A 211 212 LEU B Protein S 5 FT #SUB 194 195 SER A 205 206 GLY B Protein S 2 FT #SUB 195 196 ASP A 94 95 ARG B Protein S 3 FT #SUB 195 196 ASP A 208 209 LYS B Protein S 3 FT #SUB 197 198 VAL A 94 95 ARG B Protein S 1 FT #SUB 198 199 SER A 94 95 ARG B Protein S 3 FT #SUB 198 199 SER A 205 206 GLY B Protein S 5 FT #SUB 201 202 THR A 201 202 THR B Protein S 1 FT #SUB 205 206 GLY A 194 195 SER B Protein B 3 FT #SUB 205 206 GLY A 198 199 SER B Protein B 5 FT #SUB 206 207 THR A 189 190 THR B Protein A 7 FT #SUB 206 207 THR A 192 193 THR B Protein A 5 FT #SUB 208 209 LYS A 102 103 GLU B Protein S 1 FT #SUB 208 209 LYS A 105 106 TYR B Protein S 1 FT #SUB 208 209 LYS A 195 196 ASP B Protein S 4 FT #SUB 209 210 GLY A 192 193 THR B Protein B 3 FT #SUB 209 210 GLY A 193 194 GLU B Protein B 2 FT #SUB 209 210 GLY A 194 195 SER B Protein B 2 FT #SUB 210 211 PRO A 192 193 THR B Protein A 2 FT #SUB 210 211 PRO A 193 194 GLU B Protein S 6 FT #SUB 211 212 LEU A 192 193 THR B Protein B 1 FT #SUB 211 212 LEU A 193 194 GLU B Protein S 10 FT #SUB 253 254 VAL A 350 351 ARG B Protein S 1 FT #SUB 347 348 MET A 3 4 TYR B Protein S 3 FT #SUB 347 348 MET A 4 5 GLY B Protein S 1 FT #SUB 348 349 ILE A 4 5 GLY B Protein B 4 FT #SUB 348 349 ILE A 6 7 LYS B Protein S 1 FT #SUB 349 350 PHE A 4 5 GLY B Protein B 5 FT #SUB 350 351 ARG A 4 5 GLY B Protein B 3 FT #SUB 350 351 ARG A 5 6 LEU B Protein B 2 FT #SUB 350 351 ARG A 6 7 LYS B Protein B 2 FT #SUB 350 351 ARG A 253 254 VAL B Protein S 1 FT #SUB 351 352 PRO A 5 6 LEU B Protein B 1 FT #SUB 351 352 PRO A 8 9 ILE B Protein A 3 FT #SUB 351 352 PRO A 10 11 CYS B Protein S 2 FT #SUB 351 352 PRO A 179 180 MET B Protein A 4 FT #SUB 351 352 PRO A 184 185 PHE B Protein S 4 FT #SUB 352 353 SER A 8 9 ILE B Protein B 6 FT #SUB 352 353 SER A 9 10 THR B Protein B 8 FT #SUB 352 353 SER A 10 11 CYS B Protein B 1 FT #SUB 352 353 SER A 11 12 VAL B Protein B 1 FT #SUB 353 354 ALA A 9 10 THR B Protein B 3 FT #SUB 353 354 ALA A 11 12 VAL B Protein A 6 FT #SUB 353 354 ALA A 179 180 MET B Protein S 1 FT #SUB 354 355 GLN A 9 10 THR B Protein B 1 FT #SUB 354 355 GLN A 11 12 VAL B Protein A 5 FT #SUB 354 355 GLN A 12 13 GLU B Protein B 2 FT #SUB 354 355 GLN A 13 14 THR B Protein B 2 FT #SUB 355 356 TYR A 13 14 THR B Protein A 4 FT #SUB 355 356 TYR A 16 17 SER B Protein S 1 FT #SUB 355 356 TYR A 17 18 HIS B Protein S 6 FT #SUB 355 356 TYR A 29 30 GLY B Protein S 2 FT #SUB 356 357 THR A 12 13 GLU B Protein S 1 FT #SUB 356 357 THR A 13 14 THR B Protein A 3 FT #SUB 356 357 THR A 14 15 SER B Protein S 1 FT #SUB 357 358 GLY A 14 15 SER B Protein B 1 FT #SUB 358 359 ALA A 29 30 GLY B Protein B 1 FT #SUB 359 360 ILE A 24 25 ARG B Protein S 2 FT #SUB 360 361 PRO A 26 27 ILE B Protein S 2 FT #SUB 360 361 PRO A 29 30 GLY B Protein S 3 FT #SUB 360 361 PRO A 31 32 HIS B Protein S 6 FT #SUB 362 363 GLU A 31 32 HIS B Protein S 1 FT #HET 177 178 HIS A 2 1366 CIT A S 6 FT #HET 179 180 MET A 2 1366 CIT A B 1 FT #HET 180 181 ASN A 2 1366 CIT A A 4 FT #HET 212 213 HIS A 2 1366 CIT A S 4 FT #HET 213 214 GLY A 2 1366 CIT A B 2 FT #HET 218 219 ALA A 1 1365 COZ A S 1 FT #HET 244 245 GLU A 1 1365 COZ A B 1 FT #HET 245 246 ARG A 1 1365 COZ A A 19 FT #HET 246 247 LEU A 1 1365 COZ A A 7 FT #HET 247 248 MET A 1 1365 COZ A A 9 FT #HET 249 250 PHE A 1 1365 COZ A B 6 FT #HET 250 251 GLY A 1 1365 COZ A B 5 FT #HET 251 252 HIS A 1 1365 COZ A B 3 FT #HET 252 253 ARG A 1 1365 COZ A S 2 FT #HET 260 261 ARG A 2 1366 CIT A S 4 FT #HET 296 297 LYS A 1 1365 COZ A S 5 FT #HET 299 300 ARG A 1 1365 COZ A S 4 FT #HET 301 302 LEU A 1 1365 COZ A S 7 FT #HET 304 305 ASN A 1 1365 COZ A S 1 FT #HET 306 307 GLU A 1 1365 COZ A S 4 FT #HET 306 307 GLU A 2 1366 CIT A S 3 FT #HET 331 332 ARG A 2 1366 CIT A S 5 FT #HET 350 351 ARG A 4 1366 CIT B S 4 CC SEQUENCE 363 AA (ATOM); CC VHYGLKGITC VETSISHIDG EKGRLIYRGH HAKDIALNHS FEEAAYLILF GKLPSTEELQ CC VFKDKLAAER NLPEHIERLI QSLPNNMDDM SVLRTVVSAL GENTYTFHPK TEEAIRLIAI CC TPSIIAYRKR WTRGEQAIAP SSQYGHVENY YYMLTGEQPS EAKKKALETY MILATEHGMN CC ASTFSARVTL STESDLVSAV TAALGTMKGP LHGGAPSAVT KMLEDIGEKE HAEAYLKEKL CC EKGERLMGFG HRVYKTKDPR AEALRQKAEE VAGNDRDLDL ALHVEAEAIR LLEIYKPGRK CC LYTNVEFYAA AVMRAIDFDD ELFTPTFSAS RMVGWCAHVL EQAENNMIFR PSAQYTGAIP CC EEV CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VHYGLKGITCVETSISHIDGEKGRLIYRGHHAKDIALNHSFEEAAYLILF CC ATOM VHYGLKGITCVETSISHIDGEKGRLIYRGHHAKDIALNHSFEEAAYLILF CC ************************************************** CC SEQRES GKLPSTEELQVFKDKLAAERNLPEHIERLIQSLPNNMDDMSVLRTVVSAL CC ATOM GKLPSTEELQVFKDKLAAERNLPEHIERLIQSLPNNMDDMSVLRTVVSAL CC ************************************************** CC SEQRES GENTYTFHPKTEEAIRLIAITPSIIAYRKRWTRGEQAIAPSSQYGHVENY CC ATOM GENTYTFHPKTEEAIRLIAITPSIIAYRKRWTRGEQAIAPSSQYGHVENY CC ************************************************** CC SEQRES YYMLTGEQPSEAKKKALETYMILATEHGMNASTFSARVTLSTESDLVSAV CC ATOM YYMLTGEQPSEAKKKALETYMILATEHGMNASTFSARVTLSTESDLVSAV CC ************************************************** CC SEQRES TAALGTMKGPLHGGAPSAVTKMLEDIGEKEHAEAYLKEKLEKGERLMGFG CC ATOM TAALGTMKGPLHGGAPSAVTKMLEDIGEKEHAEAYLKEKLEKGERLMGFG CC ************************************************** CC SEQRES HRVYKTKDPRAEALRQKAEEVAGNDRDLDLALHVEAEAIRLLEIYKPGRK CC ATOM HRVYKTKDPRAEALRQKAEEVAGNDRDLDLALHVEAEAIRLLEIYKPGRK CC ************************************************** CC SEQRES LYTNVEFYAAAVMRAIDFDDELFTPTFSASRMVGWCAHVLEQAENNMIFR CC ATOM LYTNVEFYAAAVMRAIDFDDELFTPTFSASRMVGWCAHVLEQAENNMIFR CC ************************************************** CC SEQRES PSAQYTGAIPEEV CC ATOM PSAQYTGAIPEEV CC ************* SQ SEQUENCE 363 AA; MW; CN; VHYGLKGITC VETSISHIDG EKGRLIYRGH HAKDIALNHS FEEAAYLILF GKLPSTEELQ VFKDKLAAER NLPEHIERLI QSLPNNMDDM SVLRTVVSAL GENTYTFHPK TEEAIRLIAI TPSIIAYRKR WTRGEQAIAP SSQYGHVENY YYMLTGEQPS EAKKKALETY MILATEHGMN ASTFSARVTL STESDLVSAV TAALGTMKGP LHGGAPSAVT KMLEDIGEKE HAEAYLKEKL EKGERLMGFG HRVYKTKDPR AEALRQKAEE VAGNDRDLDL ALHVEAEAIR LLEIYKPGRK LYTNVEFYAA AVMRAIDFDD ELFTPTFSAS RMVGWCAHVL EQAENNMIFR PSAQYTGAIP EEV // ID 2C6XB STANDARD; PRT; 363 AA. DT CONVERTED FROM PDB (SEQRES) 2C6X DE CITRATE SYNTHASE 1 OS BACILLUS SUBTILIS CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.400 CC R-Factor 0.284 FT #SUB 1 2 VAL B 9 10 THR A Protein A 2 FT #SUB 2 3 HIS B 9 10 THR A Protein B 1 FT #SUB 2 3 HIS B 10 11 CYS A Protein B 2 FT #SUB 3 4 TYR B 12 13 GLU A Protein S 3 FT #SUB 3 4 TYR B 347 348 MET A Protein A 3 FT #SUB 4 5 GLY B 347 348 MET A Protein B 1 FT #SUB 4 5 GLY B 348 349 ILE A Protein B 4 FT #SUB 4 5 GLY B 349 350 PHE A Protein B 5 FT #SUB 4 5 GLY B 350 351 ARG A Protein B 3 FT #SUB 5 6 LEU B 5 6 LEU A Protein S 1 FT #SUB 5 6 LEU B 8 9 ILE A Protein S 1 FT #SUB 5 6 LEU B 10 11 CYS A Protein S 4 FT #SUB 5 6 LEU B 350 351 ARG A Protein B 2 FT #SUB 5 6 LEU B 351 352 PRO A Protein B 1 FT #SUB 6 7 LYS B 348 349 ILE A Protein S 1 FT #SUB 6 7 LYS B 350 351 ARG A Protein B 2 FT #SUB 8 9 ILE B 5 6 LEU A Protein S 1 FT #SUB 8 9 ILE B 351 352 PRO A Protein B 3 FT #SUB 8 9 ILE B 352 353 SER A Protein B 6 FT #SUB 9 10 THR B 1 2 VAL A Protein B 2 FT #SUB 9 10 THR B 2 3 HIS A Protein B 1 FT #SUB 9 10 THR B 352 353 SER A Protein A 8 FT #SUB 9 10 THR B 353 354 ALA A Protein S 3 FT #SUB 9 10 THR B 354 355 GLN A Protein S 1 FT #SUB 10 11 CYS B 2 3 HIS A Protein A 2 FT #SUB 10 11 CYS B 5 6 LEU A Protein S 6 FT #SUB 10 11 CYS B 351 352 PRO A Protein S 2 FT #SUB 10 11 CYS B 352 353 SER A Protein B 1 FT #SUB 11 12 VAL B 352 353 SER A Protein B 1 FT #SUB 11 12 VAL B 353 354 ALA A Protein A 6 FT #SUB 11 12 VAL B 354 355 GLN A Protein B 5 FT #SUB 12 13 GLU B 3 4 TYR A Protein S 3 FT #SUB 12 13 GLU B 354 355 GLN A Protein B 2 FT #SUB 12 13 GLU B 356 357 THR A Protein S 1 FT #SUB 13 14 THR B 354 355 GLN A Protein B 2 FT #SUB 13 14 THR B 355 356 TYR A Protein B 4 FT #SUB 13 14 THR B 356 357 THR A Protein B 3 FT #SUB 14 15 SER B 356 357 THR A Protein S 1 FT #SUB 14 15 SER B 357 358 GLY A Protein S 1 FT #SUB 16 17 SER B 355 356 TYR A Protein B 1 FT #SUB 17 18 HIS B 355 356 TYR A Protein S 6 FT #SUB 24 25 ARG B 359 360 ILE A Protein S 2 FT #SUB 26 27 ILE B 360 361 PRO A Protein S 2 FT #SUB 29 30 GLY B 355 356 TYR A Protein B 2 FT #SUB 29 30 GLY B 358 359 ALA A Protein B 1 FT #SUB 29 30 GLY B 360 361 PRO A Protein B 3 FT #SUB 31 32 HIS B 360 361 PRO A Protein S 6 FT #SUB 31 32 HIS B 362 363 GLU A Protein S 1 FT #SUB 75 76 HIS B 84 85 PRO A Protein S 3 FT #SUB 86 87 ASN B 102 103 GLU A Protein A 5 FT #SUB 86 87 ASN B 103 104 ASN A Protein A 9 FT #SUB 87 88 MET B 99 100 ALA A Protein S 1 FT #SUB 87 88 MET B 101 102 GLY A Protein S 3 FT #SUB 87 88 MET B 102 103 GLU A Protein S 1 FT #SUB 87 88 MET B 103 104 ASN A Protein B 1 FT #SUB 91 92 SER B 102 103 GLU A Protein S 1 FT #SUB 94 95 ARG B 98 99 SER A Protein S 10 FT #SUB 94 95 ARG B 195 196 ASP A Protein S 3 FT #SUB 94 95 ARG B 197 198 VAL A Protein S 1 FT #SUB 94 95 ARG B 198 199 SER A Protein S 3 FT #SUB 95 96 THR B 98 99 SER A Protein A 8 FT #SUB 98 99 SER B 94 95 ARG A Protein A 11 FT #SUB 98 99 SER B 95 96 THR A Protein A 7 FT #SUB 99 100 ALA B 87 88 MET A Protein B 2 FT #SUB 99 100 ALA B 95 96 THR A Protein B 2 FT #SUB 101 102 GLY B 87 88 MET A Protein B 3 FT #SUB 101 102 GLY B 91 92 SER A Protein B 1 FT #SUB 101 102 GLY B 94 95 ARG A Protein B 1 FT #SUB 102 103 GLU B 86 87 ASN A Protein A 9 FT #SUB 102 103 GLU B 87 88 MET A Protein S 1 FT #SUB 102 103 GLU B 88 89 ASP A Protein B 1 FT #SUB 102 103 GLU B 91 92 SER A Protein B 1 FT #SUB 102 103 GLU B 208 209 LYS A Protein B 1 FT #SUB 103 104 ASN B 86 87 ASN A Protein S 8 FT #SUB 103 104 ASN B 87 88 MET A Protein S 1 FT #SUB 105 106 TYR B 208 209 LYS A Protein B 1 FT #SUB 179 180 MET B 351 352 PRO A Protein A 4 FT #SUB 179 180 MET B 353 354 ALA A Protein S 1 FT #SUB 181 182 ALA B 192 193 THR A Protein S 1 FT #SUB 184 185 PHE B 351 352 PRO A Protein S 4 FT #SUB 185 186 SER B 189 190 THR A Protein S 1 FT #SUB 189 190 THR B 185 186 SER A Protein S 1 FT #SUB 189 190 THR B 206 207 THR A Protein A 7 FT #SUB 192 193 THR B 181 182 ALA A Protein S 1 FT #SUB 192 193 THR B 206 207 THR A Protein S 5 FT #SUB 192 193 THR B 209 210 GLY A Protein A 3 FT #SUB 192 193 THR B 210 211 PRO A Protein B 2 FT #SUB 192 193 THR B 211 212 LEU A Protein B 1 FT #SUB 193 194 GLU B 209 210 GLY A Protein B 2 FT #SUB 193 194 GLU B 210 211 PRO A Protein A 6 FT #SUB 193 194 GLU B 211 212 LEU A Protein S 10 FT #SUB 194 195 SER B 205 206 GLY A Protein S 3 FT #SUB 194 195 SER B 209 210 GLY A Protein A 2 FT #SUB 195 196 ASP B 94 95 ARG A Protein S 3 FT #SUB 195 196 ASP B 208 209 LYS A Protein S 4 FT #SUB 197 198 VAL B 94 95 ARG A Protein S 1 FT #SUB 198 199 SER B 94 95 ARG A Protein S 3 FT #SUB 198 199 SER B 205 206 GLY A Protein S 5 FT #SUB 201 202 THR B 201 202 THR A Protein S 1 FT #SUB 205 206 GLY B 194 195 SER A Protein B 2 FT #SUB 205 206 GLY B 198 199 SER A Protein B 5 FT #SUB 206 207 THR B 189 190 THR A Protein A 6 FT #SUB 206 207 THR B 192 193 THR A Protein A 4 FT #SUB 208 209 LYS B 102 103 GLU A Protein S 1 FT #SUB 208 209 LYS B 105 106 TYR A Protein S 1 FT #SUB 208 209 LYS B 195 196 ASP A Protein S 3 FT #SUB 209 210 GLY B 192 193 THR A Protein B 3 FT #SUB 210 211 PRO B 192 193 THR A Protein A 2 FT #SUB 210 211 PRO B 193 194 GLU A Protein S 5 FT #SUB 211 212 LEU B 192 193 THR A Protein B 1 FT #SUB 211 212 LEU B 193 194 GLU A Protein S 5 FT #SUB 253 254 VAL B 350 351 ARG A Protein S 1 FT #SUB 347 348 MET B 3 4 TYR A Protein S 3 FT #SUB 347 348 MET B 4 5 GLY A Protein S 1 FT #SUB 348 349 ILE B 4 5 GLY A Protein B 4 FT #SUB 348 349 ILE B 6 7 LYS A Protein S 1 FT #SUB 349 350 PHE B 4 5 GLY A Protein A 6 FT #SUB 350 351 ARG B 4 5 GLY A Protein B 2 FT #SUB 350 351 ARG B 5 6 LEU A Protein B 2 FT #SUB 350 351 ARG B 6 7 LYS A Protein B 2 FT #SUB 350 351 ARG B 253 254 VAL A Protein S 1 FT #SUB 351 352 PRO B 5 6 LEU A Protein B 1 FT #SUB 351 352 PRO B 8 9 ILE A Protein A 3 FT #SUB 351 352 PRO B 10 11 CYS A Protein S 2 FT #SUB 351 352 PRO B 179 180 MET A Protein A 4 FT #SUB 351 352 PRO B 184 185 PHE A Protein S 4 FT #SUB 352 353 SER B 8 9 ILE A Protein B 6 FT #SUB 352 353 SER B 9 10 THR A Protein A 10 FT #SUB 352 353 SER B 10 11 CYS A Protein B 1 FT #SUB 352 353 SER B 11 12 VAL A Protein B 1 FT #SUB 353 354 ALA B 9 10 THR A Protein B 3 FT #SUB 353 354 ALA B 11 12 VAL A Protein A 7 FT #SUB 353 354 ALA B 179 180 MET A Protein S 1 FT #SUB 354 355 GLN B 9 10 THR A Protein B 1 FT #SUB 354 355 GLN B 11 12 VAL A Protein A 5 FT #SUB 354 355 GLN B 12 13 GLU A Protein B 3 FT #SUB 354 355 GLN B 13 14 THR A Protein B 4 FT #SUB 355 356 TYR B 13 14 THR A Protein A 5 FT #SUB 355 356 TYR B 14 15 SER A Protein S 3 FT #SUB 355 356 TYR B 17 18 HIS A Protein S 3 FT #SUB 355 356 TYR B 29 30 GLY A Protein S 2 FT #SUB 356 357 THR B 12 13 GLU A Protein S 1 FT #SUB 356 357 THR B 13 14 THR A Protein B 2 FT #SUB 356 357 THR B 14 15 SER A Protein S 1 FT #SUB 357 358 GLY B 14 15 SER A Protein B 1 FT #SUB 358 359 ALA B 29 30 GLY A Protein B 1 FT #SUB 359 360 ILE B 24 25 ARG A Protein S 1 FT #SUB 360 361 PRO B 26 27 ILE A Protein S 2 FT #SUB 360 361 PRO B 29 30 GLY A Protein A 5 FT #SUB 360 361 PRO B 31 32 HIS A Protein S 1 FT #SUB 362 363 GLU B 24 25 ARG A Protein S 1 FT #SUB 362 363 GLU B 31 32 HIS A Protein S 2 FT #HET 177 178 HIS B 4 1366 CIT B S 6 FT #HET 179 180 MET B 4 1366 CIT B B 1 FT #HET 180 181 ASN B 4 1366 CIT B A 4 FT #HET 212 213 HIS B 4 1366 CIT B S 4 FT #HET 213 214 GLY B 4 1366 CIT B B 2 FT #HET 218 219 ALA B 3 1365 COZ B S 1 FT #HET 244 245 GLU B 3 1365 COZ B B 1 FT #HET 245 246 ARG B 3 1365 COZ B A 19 FT #HET 246 247 LEU B 3 1365 COZ B A 7 FT #HET 247 248 MET B 3 1365 COZ B A 9 FT #HET 249 250 PHE B 3 1365 COZ B B 6 FT #HET 250 251 GLY B 3 1365 COZ B B 5 FT #HET 251 252 HIS B 3 1365 COZ B B 3 FT #HET 252 253 ARG B 3 1365 COZ B S 2 FT #HET 260 261 ARG B 4 1366 CIT B S 4 FT #HET 296 297 LYS B 3 1365 COZ B S 5 FT #HET 299 300 ARG B 3 1365 COZ B S 4 FT #HET 301 302 LEU B 3 1365 COZ B S 7 FT #HET 304 305 ASN B 3 1365 COZ B S 1 FT #HET 306 307 GLU B 3 1365 COZ B S 4 FT #HET 306 307 GLU B 4 1366 CIT B S 3 FT #HET 331 332 ARG B 4 1366 CIT B S 5 FT #HET 350 351 ARG B 2 1366 CIT A S 7 CC SEQUENCE 363 AA (ATOM); CC VHYGLKGITC VETSISHIDG EKGRLIYRGH HAKDIALNHS FEEAAYLILF GKLPSTEELQ CC VFKDKLAAER NLPEHIERLI QSLPNNMDDM SVLRTVVSAL GENTYTFHPK TEEAIRLIAI CC TPSIIAYRKR WTRGEQAIAP SSQYGHVENY YYMLTGEQPS EAKKKALETY MILATEHGMN CC ASTFSARVTL STESDLVSAV TAALGTMKGP LHGGAPSAVT KMLEDIGEKE HAEAYLKEKL CC EKGERLMGFG HRVYKTKDPR AEALRQKAEE VAGNDRDLDL ALHVEAEAIR LLEIYKPGRK CC LYTNVEFYAA AVMRAIDFDD ELFTPTFSAS RMVGWCAHVL EQAENNMIFR PSAQYTGAIP CC EEV CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VHYGLKGITCVETSISHIDGEKGRLIYRGHHAKDIALNHSFEEAAYLILF CC ATOM VHYGLKGITCVETSISHIDGEKGRLIYRGHHAKDIALNHSFEEAAYLILF CC ************************************************** CC SEQRES GKLPSTEELQVFKDKLAAERNLPEHIERLIQSLPNNMDDMSVLRTVVSAL CC ATOM GKLPSTEELQVFKDKLAAERNLPEHIERLIQSLPNNMDDMSVLRTVVSAL CC ************************************************** CC SEQRES GENTYTFHPKTEEAIRLIAITPSIIAYRKRWTRGEQAIAPSSQYGHVENY CC ATOM GENTYTFHPKTEEAIRLIAITPSIIAYRKRWTRGEQAIAPSSQYGHVENY CC ************************************************** CC SEQRES YYMLTGEQPSEAKKKALETYMILATEHGMNASTFSARVTLSTESDLVSAV CC ATOM YYMLTGEQPSEAKKKALETYMILATEHGMNASTFSARVTLSTESDLVSAV CC ************************************************** CC SEQRES TAALGTMKGPLHGGAPSAVTKMLEDIGEKEHAEAYLKEKLEKGERLMGFG CC ATOM TAALGTMKGPLHGGAPSAVTKMLEDIGEKEHAEAYLKEKLEKGERLMGFG CC ************************************************** CC SEQRES HRVYKTKDPRAEALRQKAEEVAGNDRDLDLALHVEAEAIRLLEIYKPGRK CC ATOM HRVYKTKDPRAEALRQKAEEVAGNDRDLDLALHVEAEAIRLLEIYKPGRK CC ************************************************** CC SEQRES LYTNVEFYAAAVMRAIDFDDELFTPTFSASRMVGWCAHVLEQAENNMIFR CC ATOM LYTNVEFYAAAVMRAIDFDDELFTPTFSASRMVGWCAHVLEQAENNMIFR CC ************************************************** CC SEQRES PSAQYTGAIPEEV CC ATOM PSAQYTGAIPEEV CC ************* SQ SEQUENCE 363 AA; MW; CN; VHYGLKGITC VETSISHIDG EKGRLIYRGH HAKDIALNHS FEEAAYLILF GKLPSTEELQ VFKDKLAAER NLPEHIERLI QSLPNNMDDM SVLRTVVSAL GENTYTFHPK TEEAIRLIAI TPSIIAYRKR WTRGEQAIAP SSQYGHVENY YYMLTGEQPS EAKKKALETY MILATEHGMN ASTFSARVTL STESDLVSAV TAALGTMKGP LHGGAPSAVT KMLEDIGEKE HAEAYLKEKL EKGERLMGFG HRVYKTKDPR AEALRQKAEE VAGNDRDLDL ALHVEAEAIR LLEIYKPGRK LYTNVEFYAA AVMRAIDFDD ELFTPTFSAS RMVGWCAHVL EQAENNMIFR PSAQYTGAIP EEV // ID 2C6XC STANDARD; PRT; 363 AA. DT CONVERTED FROM PDB (SEQRES) 2C6X DE CITRATE SYNTHASE 1 OS BACILLUS SUBTILIS CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.400 CC R-Factor 0.284 FT #SUB 1 2 VAL C 9 10 THR D Protein A 4 FT #SUB 2 3 HIS C 8 9 ILE D Protein S 1 FT #SUB 2 3 HIS C 9 10 THR D Protein B 3 FT #SUB 2 3 HIS C 10 11 CYS D Protein B 5 FT #SUB 3 4 TYR C 10 11 CYS D Protein B 1 FT #SUB 3 4 TYR C 12 13 GLU D Protein S 8 FT #SUB 3 4 TYR C 347 348 MET D Protein A 5 FT #SUB 4 5 GLY C 10 11 CYS D Protein B 1 FT #SUB 4 5 GLY C 347 348 MET D Protein B 2 FT #SUB 4 5 GLY C 348 349 ILE D Protein B 2 FT #SUB 4 5 GLY C 349 350 PHE D Protein B 10 FT #SUB 4 5 GLY C 350 351 ARG D Protein B 1 FT #SUB 5 6 LEU C 5 6 LEU D Protein S 1 FT #SUB 5 6 LEU C 8 9 ILE D Protein S 1 FT #SUB 5 6 LEU C 10 11 CYS D Protein S 7 FT #SUB 5 6 LEU C 350 351 ARG D Protein B 1 FT #SUB 5 6 LEU C 351 352 PRO D Protein B 1 FT #SUB 6 7 LYS C 348 349 ILE D Protein S 1 FT #SUB 6 7 LYS C 350 351 ARG D Protein B 1 FT #SUB 8 9 ILE C 5 6 LEU D Protein S 1 FT #SUB 8 9 ILE C 8 9 ILE D Protein S 1 FT #SUB 8 9 ILE C 351 352 PRO D Protein B 3 FT #SUB 8 9 ILE C 352 353 SER D Protein B 2 FT #SUB 9 10 THR C 1 2 VAL D Protein B 3 FT #SUB 9 10 THR C 2 3 HIS D Protein B 1 FT #SUB 9 10 THR C 352 353 SER D Protein A 7 FT #SUB 9 10 THR C 353 354 ALA D Protein S 2 FT #SUB 9 10 THR C 354 355 GLN D Protein S 1 FT #SUB 10 11 CYS C 2 3 HIS D Protein A 3 FT #SUB 10 11 CYS C 4 5 GLY D Protein B 1 FT #SUB 10 11 CYS C 5 6 LEU D Protein S 6 FT #SUB 10 11 CYS C 351 352 PRO D Protein S 1 FT #SUB 10 11 CYS C 352 353 SER D Protein B 1 FT #SUB 11 12 VAL C 352 353 SER D Protein B 1 FT #SUB 11 12 VAL C 353 354 ALA D Protein A 6 FT #SUB 11 12 VAL C 354 355 GLN D Protein B 3 FT #SUB 12 13 GLU C 1 2 VAL D Protein S 1 FT #SUB 12 13 GLU C 3 4 TYR D Protein S 3 FT #SUB 12 13 GLU C 354 355 GLN D Protein B 2 FT #SUB 13 14 THR C 353 354 ALA D Protein S 1 FT #SUB 13 14 THR C 354 355 GLN D Protein A 7 FT #SUB 13 14 THR C 355 356 TYR D Protein B 6 FT #SUB 13 14 THR C 356 357 THR D Protein B 2 FT #SUB 14 15 SER C 355 356 TYR D Protein B 5 FT #SUB 14 15 SER C 356 357 THR D Protein S 1 FT #SUB 14 15 SER C 357 358 GLY D Protein A 2 FT #SUB 17 18 HIS C 355 356 TYR D Protein S 3 FT #SUB 24 25 ARG C 359 360 ILE D Protein S 1 FT #SUB 26 27 ILE C 360 361 PRO D Protein S 1 FT #SUB 28 29 ARG C 355 356 TYR D Protein B 1 FT #SUB 29 30 GLY C 355 356 TYR D Protein B 2 FT #SUB 29 30 GLY C 358 359 ALA D Protein B 2 FT #SUB 29 30 GLY C 360 361 PRO D Protein B 7 FT #SUB 31 32 HIS C 360 361 PRO D Protein S 2 FT #SUB 31 32 HIS C 362 363 GLU D Protein S 2 FT #SUB 84 85 PRO C 75 76 HIS D Protein S 2 FT #SUB 86 87 ASN C 102 103 GLU D Protein A 8 FT #SUB 86 87 ASN C 103 104 ASN D Protein A 4 FT #SUB 87 88 MET C 99 100 ALA D Protein S 2 FT #SUB 87 88 MET C 101 102 GLY D Protein S 3 FT #SUB 88 89 ASP C 102 103 GLU D Protein S 1 FT #SUB 91 92 SER C 101 102 GLY D Protein S 2 FT #SUB 91 92 SER C 102 103 GLU D Protein S 1 FT #SUB 94 95 ARG C 98 99 SER D Protein S 10 FT #SUB 94 95 ARG C 195 196 ASP D Protein S 2 FT #SUB 94 95 ARG C 197 198 VAL D Protein S 1 FT #SUB 94 95 ARG C 198 199 SER D Protein S 3 FT #SUB 95 96 THR C 98 99 SER D Protein A 7 FT #SUB 95 96 THR C 99 100 ALA D Protein S 1 FT #SUB 98 99 SER C 94 95 ARG D Protein A 10 FT #SUB 98 99 SER C 95 96 THR D Protein A 7 FT #SUB 99 100 ALA C 87 88 MET D Protein B 1 FT #SUB 101 102 GLY C 87 88 MET D Protein B 3 FT #SUB 102 103 GLU C 86 87 ASN D Protein A 5 FT #SUB 103 104 ASN C 86 87 ASN D Protein S 6 FT #SUB 179 180 MET C 351 352 PRO D Protein A 5 FT #SUB 179 180 MET C 353 354 ALA D Protein S 1 FT #SUB 181 182 ALA C 192 193 THR D Protein S 1 FT #SUB 184 185 PHE C 184 185 PHE D Protein S 1 FT #SUB 184 185 PHE C 351 352 PRO D Protein S 2 FT #SUB 185 186 SER C 189 190 THR D Protein S 1 FT #SUB 189 190 THR C 185 186 SER D Protein S 1 FT #SUB 189 190 THR C 206 207 THR D Protein A 6 FT #SUB 192 193 THR C 181 182 ALA D Protein S 1 FT #SUB 192 193 THR C 206 207 THR D Protein S 2 FT #SUB 192 193 THR C 209 210 GLY D Protein A 4 FT #SUB 192 193 THR C 210 211 PRO D Protein B 2 FT #SUB 192 193 THR C 211 212 LEU D Protein B 1 FT #SUB 193 194 GLU C 210 211 PRO D Protein A 5 FT #SUB 193 194 GLU C 211 212 LEU D Protein S 5 FT #SUB 194 195 SER C 205 206 GLY D Protein S 1 FT #SUB 194 195 SER C 209 210 GLY D Protein S 1 FT #SUB 195 196 ASP C 94 95 ARG D Protein S 2 FT #SUB 195 196 ASP C 208 209 LYS D Protein S 4 FT #SUB 197 198 VAL C 94 95 ARG D Protein S 1 FT #SUB 198 199 SER C 94 95 ARG D Protein S 3 FT #SUB 198 199 SER C 205 206 GLY D Protein S 3 FT #SUB 198 199 SER C 208 209 LYS D Protein S 1 FT #SUB 201 202 THR C 201 202 THR D Protein S 1 FT #SUB 205 206 GLY C 189 190 THR D Protein B 1 FT #SUB 205 206 GLY C 194 195 SER D Protein B 2 FT #SUB 205 206 GLY C 198 199 SER D Protein B 5 FT #SUB 206 207 THR C 189 190 THR D Protein A 7 FT #SUB 206 207 THR C 192 193 THR D Protein B 3 FT #SUB 208 209 LYS C 102 103 GLU D Protein S 1 FT #SUB 208 209 LYS C 105 106 TYR D Protein S 1 FT #SUB 208 209 LYS C 195 196 ASP D Protein S 5 FT #SUB 208 209 LYS C 198 199 SER D Protein S 1 FT #SUB 209 210 GLY C 192 193 THR D Protein B 3 FT #SUB 209 210 GLY C 193 194 GLU D Protein B 2 FT #SUB 209 210 GLY C 194 195 SER D Protein B 6 FT #SUB 210 211 PRO C 192 193 THR D Protein A 2 FT #SUB 210 211 PRO C 193 194 GLU D Protein A 8 FT #SUB 211 212 LEU C 192 193 THR D Protein A 8 FT #SUB 211 212 LEU C 193 194 GLU D Protein S 12 FT #SUB 212 213 HIS C 192 193 THR D Protein S 1 FT #SUB 253 254 VAL C 350 351 ARG D Protein S 1 FT #SUB 347 348 MET C 3 4 TYR D Protein S 3 FT #SUB 347 348 MET C 4 5 GLY D Protein S 1 FT #SUB 348 349 ILE C 4 5 GLY D Protein B 2 FT #SUB 348 349 ILE C 6 7 LYS D Protein S 1 FT #SUB 349 350 PHE C 4 5 GLY D Protein A 6 FT #SUB 350 351 ARG C 4 5 GLY D Protein B 2 FT #SUB 350 351 ARG C 5 6 LEU D Protein B 1 FT #SUB 350 351 ARG C 6 7 LYS D Protein B 1 FT #SUB 350 351 ARG C 253 254 VAL D Protein S 1 FT #SUB 351 352 PRO C 5 6 LEU D Protein B 1 FT #SUB 351 352 PRO C 8 9 ILE D Protein A 3 FT #SUB 351 352 PRO C 10 11 CYS D Protein S 1 FT #SUB 351 352 PRO C 179 180 MET D Protein A 4 FT #SUB 351 352 PRO C 184 185 PHE D Protein S 4 FT #SUB 352 353 SER C 8 9 ILE D Protein B 2 FT #SUB 352 353 SER C 9 10 THR D Protein B 4 FT #SUB 352 353 SER C 10 11 CYS D Protein B 1 FT #SUB 353 354 ALA C 9 10 THR D Protein B 1 FT #SUB 353 354 ALA C 11 12 VAL D Protein A 3 FT #SUB 353 354 ALA C 179 180 MET D Protein S 1 FT #SUB 354 355 GLN C 9 10 THR D Protein B 1 FT #SUB 354 355 GLN C 11 12 VAL D Protein B 1 FT #SUB 354 355 GLN C 12 13 GLU D Protein B 2 FT #SUB 354 355 GLN C 13 14 THR D Protein B 6 FT #SUB 355 356 TYR C 13 14 THR D Protein A 3 FT #SUB 355 356 TYR C 16 17 SER D Protein S 6 FT #SUB 355 356 TYR C 17 18 HIS D Protein S 11 FT #SUB 355 356 TYR C 28 29 ARG D Protein S 1 FT #SUB 355 356 TYR C 29 30 GLY D Protein S 3 FT #SUB 356 357 THR C 13 14 THR D Protein A 7 FT #SUB 356 357 THR C 14 15 SER D Protein S 6 FT #SUB 357 358 GLY C 14 15 SER D Protein B 2 FT #SUB 358 359 ALA C 29 30 GLY D Protein B 5 FT #SUB 359 360 ILE C 24 25 ARG D Protein S 3 FT #SUB 360 361 PRO C 26 27 ILE D Protein S 1 FT #SUB 360 361 PRO C 29 30 GLY D Protein A 4 FT #SUB 360 361 PRO C 31 32 HIS D Protein A 13 FT #SUB 361 362 GLU C 31 32 HIS D Protein B 1 FT #HET 177 178 HIS C 6 1366 CIT C S 6 FT #HET 179 180 MET C 6 1366 CIT C B 1 FT #HET 180 181 ASN C 6 1366 CIT C A 4 FT #HET 212 213 HIS C 6 1366 CIT C S 4 FT #HET 213 214 GLY C 6 1366 CIT C B 2 FT #HET 218 219 ALA C 5 1365 COZ C S 1 FT #HET 244 245 GLU C 5 1365 COZ C B 1 FT #HET 245 246 ARG C 5 1365 COZ C A 19 FT #HET 246 247 LEU C 5 1365 COZ C A 7 FT #HET 247 248 MET C 5 1365 COZ C A 9 FT #HET 249 250 PHE C 5 1365 COZ C B 6 FT #HET 250 251 GLY C 5 1365 COZ C B 5 FT #HET 251 252 HIS C 5 1365 COZ C B 3 FT #HET 252 253 ARG C 5 1365 COZ C S 2 FT #HET 260 261 ARG C 6 1366 CIT C S 4 FT #HET 296 297 LYS C 5 1365 COZ C S 5 FT #HET 299 300 ARG C 5 1365 COZ C S 4 FT #HET 301 302 LEU C 5 1365 COZ C S 7 FT #HET 304 305 ASN C 5 1365 COZ C S 1 FT #HET 306 307 GLU C 5 1365 COZ C S 4 FT #HET 306 307 GLU C 6 1366 CIT C S 3 FT #HET 331 332 ARG C 6 1366 CIT C S 5 FT #HET 350 351 ARG C 8 1366 CIT D S 6 CC SEQUENCE 363 AA (ATOM); CC VHYGLKGITC VETSISHIDG EKGRLIYRGH HAKDIALNHS FEEAAYLILF GKLPSTEELQ CC VFKDKLAAER NLPEHIERLI QSLPNNMDDM SVLRTVVSAL GENTYTFHPK TEEAIRLIAI CC TPSIIAYRKR WTRGEQAIAP SSQYGHVENY YYMLTGEQPS EAKKKALETY MILATEHGMN CC ASTFSARVTL STESDLVSAV TAALGTMKGP LHGGAPSAVT KMLEDIGEKE HAEAYLKEKL CC EKGERLMGFG HRVYKTKDPR AEALRQKAEE VAGNDRDLDL ALHVEAEAIR LLEIYKPGRK CC LYTNVEFYAA AVMRAIDFDD ELFTPTFSAS RMVGWCAHVL EQAENNMIFR PSAQYTGAIP CC EEV CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VHYGLKGITCVETSISHIDGEKGRLIYRGHHAKDIALNHSFEEAAYLILF CC ATOM VHYGLKGITCVETSISHIDGEKGRLIYRGHHAKDIALNHSFEEAAYLILF CC ************************************************** CC SEQRES GKLPSTEELQVFKDKLAAERNLPEHIERLIQSLPNNMDDMSVLRTVVSAL CC ATOM GKLPSTEELQVFKDKLAAERNLPEHIERLIQSLPNNMDDMSVLRTVVSAL CC ************************************************** CC SEQRES GENTYTFHPKTEEAIRLIAITPSIIAYRKRWTRGEQAIAPSSQYGHVENY CC ATOM GENTYTFHPKTEEAIRLIAITPSIIAYRKRWTRGEQAIAPSSQYGHVENY CC ************************************************** CC SEQRES YYMLTGEQPSEAKKKALETYMILATEHGMNASTFSARVTLSTESDLVSAV CC ATOM YYMLTGEQPSEAKKKALETYMILATEHGMNASTFSARVTLSTESDLVSAV CC ************************************************** CC SEQRES TAALGTMKGPLHGGAPSAVTKMLEDIGEKEHAEAYLKEKLEKGERLMGFG CC ATOM TAALGTMKGPLHGGAPSAVTKMLEDIGEKEHAEAYLKEKLEKGERLMGFG CC ************************************************** CC SEQRES HRVYKTKDPRAEALRQKAEEVAGNDRDLDLALHVEAEAIRLLEIYKPGRK CC ATOM HRVYKTKDPRAEALRQKAEEVAGNDRDLDLALHVEAEAIRLLEIYKPGRK CC ************************************************** CC SEQRES LYTNVEFYAAAVMRAIDFDDELFTPTFSASRMVGWCAHVLEQAENNMIFR CC ATOM LYTNVEFYAAAVMRAIDFDDELFTPTFSASRMVGWCAHVLEQAENNMIFR CC ************************************************** CC SEQRES PSAQYTGAIPEEV CC ATOM PSAQYTGAIPEEV CC ************* SQ SEQUENCE 363 AA; MW; CN; VHYGLKGITC VETSISHIDG EKGRLIYRGH HAKDIALNHS FEEAAYLILF GKLPSTEELQ VFKDKLAAER NLPEHIERLI QSLPNNMDDM SVLRTVVSAL GENTYTFHPK TEEAIRLIAI TPSIIAYRKR WTRGEQAIAP SSQYGHVENY YYMLTGEQPS EAKKKALETY MILATEHGMN ASTFSARVTL STESDLVSAV TAALGTMKGP LHGGAPSAVT KMLEDIGEKE HAEAYLKEKL EKGERLMGFG HRVYKTKDPR AEALRQKAEE VAGNDRDLDL ALHVEAEAIR LLEIYKPGRK LYTNVEFYAA AVMRAIDFDD ELFTPTFSAS RMVGWCAHVL EQAENNMIFR PSAQYTGAIP EEV // ID 2C6XD STANDARD; PRT; 363 AA. DT CONVERTED FROM PDB (SEQRES) 2C6X DE CITRATE SYNTHASE 1 OS BACILLUS SUBTILIS CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.400 CC R-Factor 0.284 FT #SUB 1 2 VAL D 9 10 THR C Protein A 3 FT #SUB 1 2 VAL D 12 13 GLU C Protein S 1 FT #SUB 2 3 HIS D 9 10 THR C Protein B 1 FT #SUB 2 3 HIS D 10 11 CYS C Protein B 3 FT #SUB 3 4 TYR D 12 13 GLU C Protein S 3 FT #SUB 3 4 TYR D 347 348 MET C Protein A 3 FT #SUB 4 5 GLY D 10 11 CYS C Protein B 1 FT #SUB 4 5 GLY D 347 348 MET C Protein B 1 FT #SUB 4 5 GLY D 348 349 ILE C Protein B 2 FT #SUB 4 5 GLY D 349 350 PHE C Protein B 6 FT #SUB 4 5 GLY D 350 351 ARG C Protein B 2 FT #SUB 5 6 LEU D 5 6 LEU C Protein S 1 FT #SUB 5 6 LEU D 8 9 ILE C Protein S 1 FT #SUB 5 6 LEU D 10 11 CYS C Protein S 6 FT #SUB 5 6 LEU D 350 351 ARG C Protein B 1 FT #SUB 5 6 LEU D 351 352 PRO C Protein B 1 FT #SUB 6 7 LYS D 348 349 ILE C Protein S 1 FT #SUB 6 7 LYS D 350 351 ARG C Protein B 1 FT #SUB 8 9 ILE D 2 3 HIS C Protein S 1 FT #SUB 8 9 ILE D 5 6 LEU C Protein S 1 FT #SUB 8 9 ILE D 8 9 ILE C Protein S 1 FT #SUB 8 9 ILE D 351 352 PRO C Protein B 3 FT #SUB 8 9 ILE D 352 353 SER C Protein B 2 FT #SUB 9 10 THR D 1 2 VAL C Protein A 4 FT #SUB 9 10 THR D 2 3 HIS C Protein B 3 FT #SUB 9 10 THR D 352 353 SER C Protein A 4 FT #SUB 9 10 THR D 353 354 ALA C Protein S 1 FT #SUB 9 10 THR D 354 355 GLN C Protein S 1 FT #SUB 10 11 CYS D 2 3 HIS C Protein A 5 FT #SUB 10 11 CYS D 3 4 TYR C Protein B 1 FT #SUB 10 11 CYS D 4 5 GLY C Protein B 1 FT #SUB 10 11 CYS D 5 6 LEU C Protein A 7 FT #SUB 10 11 CYS D 351 352 PRO C Protein S 1 FT #SUB 10 11 CYS D 352 353 SER C Protein B 1 FT #SUB 11 12 VAL D 353 354 ALA C Protein B 3 FT #SUB 11 12 VAL D 354 355 GLN C Protein B 1 FT #SUB 12 13 GLU D 3 4 TYR C Protein S 8 FT #SUB 12 13 GLU D 354 355 GLN C Protein B 2 FT #SUB 13 14 THR D 354 355 GLN C Protein A 6 FT #SUB 13 14 THR D 355 356 TYR C Protein B 3 FT #SUB 13 14 THR D 356 357 THR C Protein B 7 FT #SUB 14 15 SER D 356 357 THR C Protein A 6 FT #SUB 14 15 SER D 357 358 GLY C Protein A 2 FT #SUB 16 17 SER D 355 356 TYR C Protein B 6 FT #SUB 17 18 HIS D 355 356 TYR C Protein A 11 FT #SUB 24 25 ARG D 359 360 ILE C Protein S 3 FT #SUB 26 27 ILE D 360 361 PRO C Protein S 1 FT #SUB 28 29 ARG D 355 356 TYR C Protein B 1 FT #SUB 29 30 GLY D 355 356 TYR C Protein B 3 FT #SUB 29 30 GLY D 358 359 ALA C Protein B 5 FT #SUB 29 30 GLY D 360 361 PRO C Protein B 4 FT #SUB 31 32 HIS D 360 361 PRO C Protein A 13 FT #SUB 31 32 HIS D 361 362 GLU C Protein S 1 FT #SUB 75 76 HIS D 84 85 PRO C Protein S 2 FT #SUB 86 87 ASN D 102 103 GLU C Protein A 5 FT #SUB 86 87 ASN D 103 104 ASN C Protein A 6 FT #SUB 87 88 MET D 99 100 ALA C Protein S 1 FT #SUB 87 88 MET D 101 102 GLY C Protein S 3 FT #SUB 94 95 ARG D 98 99 SER C Protein S 10 FT #SUB 94 95 ARG D 195 196 ASP C Protein S 2 FT #SUB 94 95 ARG D 197 198 VAL C Protein S 1 FT #SUB 94 95 ARG D 198 199 SER C Protein S 3 FT #SUB 95 96 THR D 98 99 SER C Protein A 7 FT #SUB 98 99 SER D 94 95 ARG C Protein A 10 FT #SUB 98 99 SER D 95 96 THR C Protein A 7 FT #SUB 99 100 ALA D 87 88 MET C Protein B 2 FT #SUB 99 100 ALA D 95 96 THR C Protein B 1 FT #SUB 101 102 GLY D 87 88 MET C Protein B 3 FT #SUB 101 102 GLY D 91 92 SER C Protein B 2 FT #SUB 102 103 GLU D 86 87 ASN C Protein A 8 FT #SUB 102 103 GLU D 88 89 ASP C Protein B 1 FT #SUB 102 103 GLU D 91 92 SER C Protein B 1 FT #SUB 102 103 GLU D 208 209 LYS C Protein B 1 FT #SUB 103 104 ASN D 86 87 ASN C Protein S 4 FT #SUB 105 106 TYR D 208 209 LYS C Protein B 1 FT #SUB 179 180 MET D 351 352 PRO C Protein A 4 FT #SUB 179 180 MET D 353 354 ALA C Protein S 1 FT #SUB 181 182 ALA D 192 193 THR C Protein S 1 FT #SUB 184 185 PHE D 184 185 PHE C Protein S 1 FT #SUB 184 185 PHE D 351 352 PRO C Protein S 4 FT #SUB 185 186 SER D 189 190 THR C Protein S 1 FT #SUB 189 190 THR D 185 186 SER C Protein S 1 FT #SUB 189 190 THR D 205 206 GLY C Protein S 1 FT #SUB 189 190 THR D 206 207 THR C Protein A 7 FT #SUB 192 193 THR D 181 182 ALA C Protein S 1 FT #SUB 192 193 THR D 206 207 THR C Protein S 3 FT #SUB 192 193 THR D 209 210 GLY C Protein A 3 FT #SUB 192 193 THR D 210 211 PRO C Protein B 2 FT #SUB 192 193 THR D 211 212 LEU C Protein B 8 FT #SUB 192 193 THR D 212 213 HIS C Protein S 1 FT #SUB 193 194 GLU D 209 210 GLY C Protein B 2 FT #SUB 193 194 GLU D 210 211 PRO C Protein A 8 FT #SUB 193 194 GLU D 211 212 LEU C Protein A 12 FT #SUB 194 195 SER D 205 206 GLY C Protein S 2 FT #SUB 194 195 SER D 209 210 GLY C Protein A 6 FT #SUB 195 196 ASP D 94 95 ARG C Protein S 2 FT #SUB 195 196 ASP D 208 209 LYS C Protein S 5 FT #SUB 197 198 VAL D 94 95 ARG C Protein S 1 FT #SUB 198 199 SER D 94 95 ARG C Protein S 3 FT #SUB 198 199 SER D 205 206 GLY C Protein S 5 FT #SUB 198 199 SER D 208 209 LYS C Protein S 1 FT #SUB 201 202 THR D 201 202 THR C Protein S 1 FT #SUB 205 206 GLY D 194 195 SER C Protein B 1 FT #SUB 205 206 GLY D 198 199 SER C Protein B 3 FT #SUB 206 207 THR D 189 190 THR C Protein A 6 FT #SUB 206 207 THR D 192 193 THR C Protein B 2 FT #SUB 208 209 LYS D 195 196 ASP C Protein S 4 FT #SUB 208 209 LYS D 198 199 SER C Protein S 1 FT #SUB 209 210 GLY D 192 193 THR C Protein B 4 FT #SUB 209 210 GLY D 194 195 SER C Protein B 1 FT #SUB 210 211 PRO D 192 193 THR C Protein A 2 FT #SUB 210 211 PRO D 193 194 GLU C Protein S 5 FT #SUB 211 212 LEU D 192 193 THR C Protein B 1 FT #SUB 211 212 LEU D 193 194 GLU C Protein S 5 FT #SUB 253 254 VAL D 350 351 ARG C Protein S 1 FT #SUB 347 348 MET D 3 4 TYR C Protein S 5 FT #SUB 347 348 MET D 4 5 GLY C Protein S 2 FT #SUB 348 349 ILE D 4 5 GLY C Protein B 2 FT #SUB 348 349 ILE D 6 7 LYS C Protein S 1 FT #SUB 349 350 PHE D 4 5 GLY C Protein A 10 FT #SUB 350 351 ARG D 4 5 GLY C Protein B 1 FT #SUB 350 351 ARG D 5 6 LEU C Protein B 1 FT #SUB 350 351 ARG D 6 7 LYS C Protein B 1 FT #SUB 350 351 ARG D 253 254 VAL C Protein S 1 FT #SUB 351 352 PRO D 5 6 LEU C Protein B 1 FT #SUB 351 352 PRO D 8 9 ILE C Protein A 3 FT #SUB 351 352 PRO D 10 11 CYS C Protein S 1 FT #SUB 351 352 PRO D 179 180 MET C Protein A 5 FT #SUB 351 352 PRO D 184 185 PHE C Protein S 2 FT #SUB 352 353 SER D 8 9 ILE C Protein B 2 FT #SUB 352 353 SER D 9 10 THR C Protein B 7 FT #SUB 352 353 SER D 10 11 CYS C Protein B 1 FT #SUB 352 353 SER D 11 12 VAL C Protein B 1 FT #SUB 353 354 ALA D 9 10 THR C Protein B 2 FT #SUB 353 354 ALA D 11 12 VAL C Protein A 6 FT #SUB 353 354 ALA D 13 14 THR C Protein S 1 FT #SUB 353 354 ALA D 179 180 MET C Protein S 1 FT #SUB 354 355 GLN D 9 10 THR C Protein B 1 FT #SUB 354 355 GLN D 11 12 VAL C Protein B 3 FT #SUB 354 355 GLN D 12 13 GLU C Protein B 2 FT #SUB 354 355 GLN D 13 14 THR C Protein B 7 FT #SUB 355 356 TYR D 13 14 THR C Protein A 6 FT #SUB 355 356 TYR D 14 15 SER C Protein S 5 FT #SUB 355 356 TYR D 17 18 HIS C Protein S 3 FT #SUB 355 356 TYR D 28 29 ARG C Protein S 1 FT #SUB 355 356 TYR D 29 30 GLY C Protein S 2 FT #SUB 356 357 THR D 13 14 THR C Protein B 2 FT #SUB 356 357 THR D 14 15 SER C Protein S 1 FT #SUB 357 358 GLY D 14 15 SER C Protein B 2 FT #SUB 358 359 ALA D 29 30 GLY C Protein B 2 FT #SUB 359 360 ILE D 24 25 ARG C Protein S 1 FT #SUB 360 361 PRO D 26 27 ILE C Protein S 1 FT #SUB 360 361 PRO D 29 30 GLY C Protein A 7 FT #SUB 360 361 PRO D 31 32 HIS C Protein S 2 FT #SUB 362 363 GLU D 31 32 HIS C Protein S 2 FT #HET 177 178 HIS D 8 1366 CIT D S 6 FT #HET 179 180 MET D 8 1366 CIT D B 1 FT #HET 180 181 ASN D 8 1366 CIT D A 4 FT #HET 212 213 HIS D 8 1366 CIT D S 4 FT #HET 213 214 GLY D 8 1366 CIT D B 2 FT #HET 218 219 ALA D 7 1365 COZ D S 1 FT #HET 244 245 GLU D 7 1365 COZ D B 1 FT #HET 245 246 ARG D 7 1365 COZ D A 19 FT #HET 246 247 LEU D 7 1365 COZ D A 7 FT #HET 247 248 MET D 7 1365 COZ D A 9 FT #HET 249 250 PHE D 7 1365 COZ D B 6 FT #HET 250 251 GLY D 7 1365 COZ D B 5 FT #HET 251 252 HIS D 7 1365 COZ D B 3 FT #HET 252 253 ARG D 7 1365 COZ D S 2 FT #HET 260 261 ARG D 8 1366 CIT D S 4 FT #HET 296 297 LYS D 7 1365 COZ D S 5 FT #HET 299 300 ARG D 7 1365 COZ D S 4 FT #HET 301 302 LEU D 7 1365 COZ D S 7 FT #HET 304 305 ASN D 7 1365 COZ D S 1 FT #HET 306 307 GLU D 7 1365 COZ D S 4 FT #HET 306 307 GLU D 8 1366 CIT D S 3 FT #HET 331 332 ARG D 8 1366 CIT D S 5 FT #HET 350 351 ARG D 6 1366 CIT C S 9 CC SEQUENCE 363 AA (ATOM); CC VHYGLKGITC VETSISHIDG EKGRLIYRGH HAKDIALNHS FEEAAYLILF GKLPSTEELQ CC VFKDKLAAER NLPEHIERLI QSLPNNMDDM SVLRTVVSAL GENTYTFHPK TEEAIRLIAI CC TPSIIAYRKR WTRGEQAIAP SSQYGHVENY YYMLTGEQPS EAKKKALETY MILATEHGMN CC ASTFSARVTL STESDLVSAV TAALGTMKGP LHGGAPSAVT KMLEDIGEKE HAEAYLKEKL CC EKGERLMGFG HRVYKTKDPR AEALRQKAEE VAGNDRDLDL ALHVEAEAIR LLEIYKPGRK CC LYTNVEFYAA AVMRAIDFDD ELFTPTFSAS RMVGWCAHVL EQAENNMIFR PSAQYTGAIP CC EEV CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VHYGLKGITCVETSISHIDGEKGRLIYRGHHAKDIALNHSFEEAAYLILF CC ATOM VHYGLKGITCVETSISHIDGEKGRLIYRGHHAKDIALNHSFEEAAYLILF CC ************************************************** CC SEQRES GKLPSTEELQVFKDKLAAERNLPEHIERLIQSLPNNMDDMSVLRTVVSAL CC ATOM GKLPSTEELQVFKDKLAAERNLPEHIERLIQSLPNNMDDMSVLRTVVSAL CC ************************************************** CC SEQRES GENTYTFHPKTEEAIRLIAITPSIIAYRKRWTRGEQAIAPSSQYGHVENY CC ATOM GENTYTFHPKTEEAIRLIAITPSIIAYRKRWTRGEQAIAPSSQYGHVENY CC ************************************************** CC SEQRES YYMLTGEQPSEAKKKALETYMILATEHGMNASTFSARVTLSTESDLVSAV CC ATOM YYMLTGEQPSEAKKKALETYMILATEHGMNASTFSARVTLSTESDLVSAV CC ************************************************** CC SEQRES TAALGTMKGPLHGGAPSAVTKMLEDIGEKEHAEAYLKEKLEKGERLMGFG CC ATOM TAALGTMKGPLHGGAPSAVTKMLEDIGEKEHAEAYLKEKLEKGERLMGFG CC ************************************************** CC SEQRES HRVYKTKDPRAEALRQKAEEVAGNDRDLDLALHVEAEAIRLLEIYKPGRK CC ATOM HRVYKTKDPRAEALRQKAEEVAGNDRDLDLALHVEAEAIRLLEIYKPGRK CC ************************************************** CC SEQRES LYTNVEFYAAAVMRAIDFDDELFTPTFSASRMVGWCAHVLEQAENNMIFR CC ATOM LYTNVEFYAAAVMRAIDFDDELFTPTFSASRMVGWCAHVLEQAENNMIFR CC ************************************************** CC SEQRES PSAQYTGAIPEEV CC ATOM PSAQYTGAIPEEV CC ************* SQ SEQUENCE 363 AA; MW; CN; VHYGLKGITC VETSISHIDG EKGRLIYRGH HAKDIALNHS FEEAAYLILF GKLPSTEELQ VFKDKLAAER NLPEHIERLI QSLPNNMDDM SVLRTVVSAL GENTYTFHPK TEEAIRLIAI TPSIIAYRKR WTRGEQAIAP SSQYGHVENY YYMLTGEQPS EAKKKALETY MILATEHGMN ASTFSARVTL STESDLVSAV TAALGTMKGP LHGGAPSAVT KMLEDIGEKE HAEAYLKEKL EKGERLMGFG HRVYKTKDPR AEALRQKAEE VAGNDRDLDL ALHVEAEAIR LLEIYKPGRK LYTNVEFYAA AVMRAIDFDD ELFTPTFSAS RMVGWCAHVL EQAENNMIFR PSAQYTGAIP EEV //