ID 1CI7A STANDARD; PRT; 297 AA. DT CONVERTED FROM PDB (SEQRES) 1CI7 DE PROTEIN (THYMIDYLATE SYNTHASE) OS Pneumocystis carinii CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.600 CC R-Factor 0.221 FT #SUB 21 21 GLU A 180 180 TYR B Protein S 2 FT #SUB 21 21 GLU A 182 182 HIS B Protein S 8 FT #SUB 21 21 GLU A 183 183 ILE B Protein S 2 FT #SUB 23 23 ARG A 151 151 TYR B Protein S 4 FT #SUB 23 23 ARG A 180 180 TYR B Protein S 16 FT #SUB 23 23 ARG A 181 181 VAL B Protein S 5 FT #SUB 23 23 ARG A 182 182 HIS B Protein S 2 FT #SUB 24 24 PRO A 151 151 TYR B Protein S 4 FT #SUB 25 25 ASP A 153 153 ARG B Protein S 1 FT #SUB 26 26 ARG A 154 154 ARG B Protein S 3 FT #SUB 33 33 SER A 180 180 TYR B Protein A 6 FT #SUB 35 35 PHE A 178 178 GLN B Protein S 4 FT #SUB 35 35 PHE A 180 180 TYR B Protein S 18 FT #SUB 35 35 PHE A 193 193 SER B Protein S 2 FT #SUB 35 35 PHE A 195 195 GLN B Protein S 5 FT #SUB 36 36 ALA A 233 233 ILE B Protein S 1 FT #SUB 39 39 PRO A 39 39 PRO B Protein S 3 FT #SUB 120 120 PHE A 161 161 ASN B Protein S 1 FT #SUB 120 120 PHE A 162 162 PRO B Protein S 6 FT #SUB 120 120 PHE A 163 163 ALA B Protein S 1 FT #SUB 121 121 GLY A 163 163 ALA B Protein B 1 FT #SUB 136 136 VAL A 162 162 PRO B Protein S 1 FT #SUB 138 138 GLN A 162 162 PRO B Protein S 2 FT #SUB 151 151 TYR A 23 23 ARG B Protein A 7 FT #SUB 151 151 TYR A 24 24 PRO B Protein S 5 FT #SUB 153 153 ARG A 25 25 ASP B Protein S 2 FT #SUB 153 153 ARG A 27 27 THR B Protein S 1 FT #SUB 153 153 ARG A 199 199 ARG B Protein B 4 FT #SUB 153 153 ARG A 200 200 SER B Protein S 4 FT #SUB 153 153 ARG A 238 238 ASP B Protein S 5 FT #SUB 153 153 ARG A 240 240 HIS B Protein S 5 FT #SUB 154 154 ARG A 26 26 ARG B Protein S 3 FT #SUB 154 154 ARG A 171 171 PRO B Protein S 7 FT #SUB 154 154 ARG A 199 199 ARG B Protein S 1 FT #SUB 156 156 ILE A 160 160 TRP B Protein S 6 FT #SUB 156 156 ILE A 175 175 MET B Protein S 2 FT #SUB 160 160 TRP A 154 154 ARG B Protein S 2 FT #SUB 160 160 TRP A 156 156 ILE B Protein S 10 FT #SUB 161 161 ASN A 120 120 PHE B Protein S 2 FT #SUB 162 162 PRO A 120 120 PHE B Protein A 7 FT #SUB 162 162 PRO A 136 136 VAL B Protein B 3 FT #SUB 162 162 PRO A 138 138 GLN B Protein S 2 FT #SUB 163 163 ALA A 120 120 PHE B Protein A 2 FT #SUB 163 163 ALA A 136 136 VAL B Protein A 3 FT #SUB 171 171 PRO A 154 154 ARG B Protein S 11 FT #SUB 175 175 MET A 156 156 ILE B Protein S 3 FT #SUB 175 175 MET A 176 176 PHE B Protein S 3 FT #SUB 176 176 PHE A 175 175 MET B Protein S 6 FT #SUB 176 176 PHE A 176 176 PHE B Protein S 8 FT #SUB 176 176 PHE A 197 197 TYR B Protein S 3 FT #SUB 178 178 GLN A 35 35 PHE B Protein A 3 FT #SUB 178 178 GLN A 197 197 TYR B Protein S 6 FT #SUB 178 178 GLN A 199 199 ARG B Protein S 11 FT #SUB 178 178 GLN A 237 237 GLY B Protein S 1 FT #SUB 180 180 TYR A 23 23 ARG B Protein S 12 FT #SUB 180 180 TYR A 33 33 SER B Protein S 4 FT #SUB 180 180 TYR A 35 35 PHE B Protein S 20 FT #SUB 180 180 TYR A 238 238 ASP B Protein S 6 FT #SUB 181 181 VAL A 23 23 ARG B Protein B 4 FT #SUB 182 182 HIS A 21 21 GLU B Protein A 9 FT #SUB 182 182 HIS A 23 23 ARG B Protein B 2 FT #SUB 183 183 ILE A 21 21 GLU B Protein B 2 FT #SUB 193 193 SER A 35 35 PHE B Protein S 1 FT #SUB 195 195 GLN A 35 35 PHE B Protein S 1 FT #SUB 195 195 GLN A 36 36 ALA B Protein S 3 FT #SUB 195 195 GLN A 197 197 TYR B Protein S 7 FT #SUB 195 195 GLN A 236 236 MET B Protein S 3 FT #SUB 195 195 GLN A 237 237 GLY B Protein S 2 FT #SUB 197 197 TYR A 176 176 PHE B Protein S 4 FT #SUB 197 197 TYR A 178 178 GLN B Protein S 6 FT #SUB 197 197 TYR A 195 195 GLN B Protein S 8 FT #SUB 199 199 ARG A 153 153 ARG B Protein S 7 FT #SUB 199 199 ARG A 154 154 ARG B Protein S 1 FT #SUB 199 199 ARG A 178 178 GLN B Protein A 11 FT #SUB 200 200 SER A 153 153 ARG B Protein S 5 FT #SUB 233 233 ILE A 36 36 ALA B Protein S 2 FT #SUB 235 235 VAL A 195 195 GLN B Protein S 1 FT #SUB 236 236 MET A 195 195 GLN B Protein B 3 FT #SUB 237 237 GLY A 178 178 GLN B Protein B 3 FT #SUB 237 237 GLY A 195 195 GLN B Protein B 2 FT #SUB 238 238 ASP A 153 153 ARG B Protein S 2 FT #SUB 238 238 ASP A 178 178 GLN B Protein B 1 FT #SUB 238 238 ASP A 180 180 TYR B Protein S 3 FT #SUB 240 240 HIS A 153 153 ARG B Protein S 7 FT #SUB 242 242 TYR A 153 153 ARG B Protein S 1 FT #HET 26 26 ARG A 1 767 UMP A S 5 FT #HET 56 56 ARG A 2 768 CB3 A B 1 FT #HET 57 57 VAL A 2 768 CB3 A A 5 FT #HET 58 58 PHE A 2 768 CB3 A A 19 FT #HET 86 86 ILE A 2 768 CB3 A S 4 FT #HET 90 90 ASN A 2 768 CB3 A S 2 FT #HET 153 153 ARG A 3 765 UMP B A 14 FT #HET 154 154 ARG A 3 765 UMP B S 14 FT #HET 170 170 LEU A 1 767 UMP A S 1 FT #HET 171 171 PRO A 1 767 UMP A S 1 FT #HET 173 173 CYS A 1 767 UMP A S 14 FT #HET 174 174 HIS A 1 767 UMP A S 1 FT #HET 198 198 GLN A 1 767 UMP A S 1 FT #HET 199 199 ARG A 1 767 UMP A S 11 FT #HET 200 200 SER A 1 767 UMP A A 12 FT #HET 201 201 CYS A 1 767 UMP A B 2 FT #HET 202 202 ASP A 1 767 UMP A A 5 FT #HET 202 202 ASP A 2 768 CB3 A S 5 FT #HET 206 206 GLY A 1 767 UMP A B 1 FT #HET 206 206 GLY A 2 768 CB3 A B 2 FT #HET 209 209 PHE A 2 768 CB3 A S 18 FT #HET 210 210 ASN A 1 767 UMP A S 5 FT #HET 210 210 ASN A 2 768 CB3 A A 5 FT #HET 240 240 HIS A 1 767 UMP A S 1 FT #HET 242 242 TYR A 1 767 UMP A S 3 FT #HET 242 242 TYR A 2 768 CB3 A S 2 FT #HET 295 295 MET A 2 768 CB3 A S 4 FT #HET 296 296 SER A 2 768 CB3 A A 6 FT DISORDER 1 2 FT DISORDER 186 188 CC SEQUENCE 292 AA (ATOM); CC NAEEQQYLNL VQYIINHGED RPDRTGTGTL SVFAPSPLKF SLRNKTFPLL TTKRVFIRGV CC IEELLWFIRG ETDSLKLREK NIHIWDANGS REYLDSIGLT KRQEGDLGPI YGFQWRHFGA CC EYIDCKTNYI GQGVDQLANI IQKIRTSPYD RRLILSAWNP ADLEKMALPP CHMFCQFYVH CC IPSRPELSCQ LYQRSCDMGL GVPFNIASYA LLTCMIAHVC DLDPGDFIHV MGDCHIYKDH CC IEALQQQLTR SPRPFPTLSL NRSITDIEDF TLDDFNIQNY HPYETIKMKM SI CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MVNAEEQQYLNLVQYIINHGEDRPDRTGTGTLSVFAPSPLKFSLRNKTFP CC ATOM --NAEEQQYLNLVQYIINHGEDRPDRTGTGTLSVFAPSPLKFSLRNKTFP CC ************************************************ CC SEQRES LLTTKRVFIRGVIEELLWFIRGETDSLKLREKNIHIWDANGSREYLDSIG CC ATOM LLTTKRVFIRGVIEELLWFIRGETDSLKLREKNIHIWDANGSREYLDSIG CC ************************************************** CC SEQRES LTKRQEGDLGPIYGFQWRHFGAEYIDCKTNYIGQGVDQLANIIQKIRTSP CC ATOM LTKRQEGDLGPIYGFQWRHFGAEYIDCKTNYIGQGVDQLANIIQKIRTSP CC ************************************************** CC SEQRES YDRRLILSAWNPADLEKMALPPCHMFCQFYVHIPSNNHRPELSCQLYQRS CC ATOM YDRRLILSAWNPADLEKMALPPCHMFCQFYVHIPS---RPELSCQLYQRS CC *********************************** ************ CC SEQRES CDMGLGVPFNIASYALLTCMIAHVCDLDPGDFIHVMGDCHIYKDHIEALQ CC ATOM CDMGLGVPFNIASYALLTCMIAHVCDLDPGDFIHVMGDCHIYKDHIEALQ CC ************************************************** CC SEQRES QQLTRSPRPFPTLSLNRSITDIEDFTLDDFNIQNYHPYETIKMKMSI CC ATOM QQLTRSPRPFPTLSLNRSITDIEDFTLDDFNIQNYHPYETIKMKMSI CC *********************************************** SQ SEQUENCE 297 AA; MW; CN; MVNAEEQQYL NLVQYIINHG EDRPDRTGTG TLSVFAPSPL KFSLRNKTFP LLTTKRVFIR GVIEELLWFI RGETDSLKLR EKNIHIWDAN GSREYLDSIG LTKRQEGDLG PIYGFQWRHF GAEYIDCKTN YIGQGVDQLA NIIQKIRTSP YDRRLILSAW NPADLEKMAL PPCHMFCQFY VHIPSNNHRP ELSCQLYQRS CDMGLGVPFN IASYALLTCM IAHVCDLDPG DFIHVMGDCH IYKDHIEALQ QQLTRSPRPF PTLSLNRSIT DIEDFTLDDF NIQNYHPYET IKMKMSI // ID 1CI7B STANDARD; PRT; 297 AA. DT CONVERTED FROM PDB (SEQRES) 1CI7 DE PROTEIN (THYMIDYLATE SYNTHASE) OS Pneumocystis carinii CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.600 CC R-Factor 0.221 FT #SUB 21 21 GLU B 182 182 HIS A Protein S 9 FT #SUB 21 21 GLU B 183 183 ILE A Protein S 2 FT #SUB 23 23 ARG B 151 151 TYR A Protein S 7 FT #SUB 23 23 ARG B 180 180 TYR A Protein S 12 FT #SUB 23 23 ARG B 181 181 VAL A Protein S 4 FT #SUB 23 23 ARG B 182 182 HIS A Protein S 2 FT #SUB 24 24 PRO B 151 151 TYR A Protein A 5 FT #SUB 25 25 ASP B 153 153 ARG A Protein S 2 FT #SUB 26 26 ARG B 154 154 ARG A Protein S 3 FT #SUB 27 27 THR B 153 153 ARG A Protein S 1 FT #SUB 33 33 SER B 180 180 TYR A Protein A 4 FT #SUB 35 35 PHE B 178 178 GLN A Protein S 3 FT #SUB 35 35 PHE B 180 180 TYR A Protein S 20 FT #SUB 35 35 PHE B 193 193 SER A Protein S 1 FT #SUB 35 35 PHE B 195 195 GLN A Protein S 1 FT #SUB 36 36 ALA B 195 195 GLN A Protein A 3 FT #SUB 36 36 ALA B 233 233 ILE A Protein A 2 FT #SUB 39 39 PRO B 39 39 PRO A Protein S 3 FT #SUB 120 120 PHE B 161 161 ASN A Protein S 2 FT #SUB 120 120 PHE B 162 162 PRO A Protein S 7 FT #SUB 120 120 PHE B 163 163 ALA A Protein S 2 FT #SUB 136 136 VAL B 162 162 PRO A Protein S 3 FT #SUB 136 136 VAL B 163 163 ALA A Protein S 3 FT #SUB 138 138 GLN B 162 162 PRO A Protein S 2 FT #SUB 151 151 TYR B 23 23 ARG A Protein A 4 FT #SUB 151 151 TYR B 24 24 PRO A Protein S 4 FT #SUB 153 153 ARG B 25 25 ASP A Protein S 1 FT #SUB 153 153 ARG B 199 199 ARG A Protein A 7 FT #SUB 153 153 ARG B 200 200 SER A Protein S 5 FT #SUB 153 153 ARG B 238 238 ASP A Protein S 2 FT #SUB 153 153 ARG B 240 240 HIS A Protein S 7 FT #SUB 153 153 ARG B 242 242 TYR A Protein S 1 FT #SUB 154 154 ARG B 26 26 ARG A Protein S 3 FT #SUB 154 154 ARG B 160 160 TRP A Protein B 2 FT #SUB 154 154 ARG B 171 171 PRO A Protein S 11 FT #SUB 154 154 ARG B 199 199 ARG A Protein S 1 FT #SUB 156 156 ILE B 160 160 TRP A Protein S 10 FT #SUB 156 156 ILE B 175 175 MET A Protein S 3 FT #SUB 160 160 TRP B 156 156 ILE A Protein S 6 FT #SUB 161 161 ASN B 120 120 PHE A Protein S 1 FT #SUB 162 162 PRO B 120 120 PHE A Protein S 6 FT #SUB 162 162 PRO B 136 136 VAL A Protein S 1 FT #SUB 162 162 PRO B 138 138 GLN A Protein S 2 FT #SUB 163 163 ALA B 120 120 PHE A Protein B 1 FT #SUB 163 163 ALA B 121 121 GLY A Protein S 1 FT #SUB 171 171 PRO B 154 154 ARG A Protein S 7 FT #SUB 175 175 MET B 156 156 ILE A Protein S 2 FT #SUB 175 175 MET B 176 176 PHE A Protein S 6 FT #SUB 176 176 PHE B 175 175 MET A Protein S 3 FT #SUB 176 176 PHE B 176 176 PHE A Protein S 8 FT #SUB 176 176 PHE B 197 197 TYR A Protein S 4 FT #SUB 178 178 GLN B 35 35 PHE A Protein A 4 FT #SUB 178 178 GLN B 197 197 TYR A Protein S 6 FT #SUB 178 178 GLN B 199 199 ARG A Protein S 11 FT #SUB 178 178 GLN B 237 237 GLY A Protein S 3 FT #SUB 178 178 GLN B 238 238 ASP A Protein S 1 FT #SUB 180 180 TYR B 21 21 GLU A Protein S 2 FT #SUB 180 180 TYR B 23 23 ARG A Protein S 16 FT #SUB 180 180 TYR B 33 33 SER A Protein S 6 FT #SUB 180 180 TYR B 35 35 PHE A Protein S 18 FT #SUB 180 180 TYR B 238 238 ASP A Protein S 3 FT #SUB 181 181 VAL B 23 23 ARG A Protein B 5 FT #SUB 182 182 HIS B 21 21 GLU A Protein A 8 FT #SUB 182 182 HIS B 23 23 ARG A Protein B 2 FT #SUB 183 183 ILE B 21 21 GLU A Protein B 2 FT #SUB 193 193 SER B 35 35 PHE A Protein S 2 FT #SUB 195 195 GLN B 35 35 PHE A Protein A 5 FT #SUB 195 195 GLN B 197 197 TYR A Protein S 8 FT #SUB 195 195 GLN B 235 235 VAL A Protein S 1 FT #SUB 195 195 GLN B 236 236 MET A Protein S 3 FT #SUB 195 195 GLN B 237 237 GLY A Protein S 2 FT #SUB 197 197 TYR B 176 176 PHE A Protein S 3 FT #SUB 197 197 TYR B 178 178 GLN A Protein S 6 FT #SUB 197 197 TYR B 195 195 GLN A Protein S 7 FT #SUB 199 199 ARG B 153 153 ARG A Protein S 4 FT #SUB 199 199 ARG B 154 154 ARG A Protein S 1 FT #SUB 199 199 ARG B 178 178 GLN A Protein A 11 FT #SUB 200 200 SER B 153 153 ARG A Protein S 4 FT #SUB 233 233 ILE B 36 36 ALA A Protein S 1 FT #SUB 236 236 MET B 195 195 GLN A Protein B 3 FT #SUB 237 237 GLY B 178 178 GLN A Protein B 1 FT #SUB 237 237 GLY B 195 195 GLN A Protein B 2 FT #SUB 238 238 ASP B 153 153 ARG A Protein S 5 FT #SUB 238 238 ASP B 180 180 TYR A Protein S 6 FT #SUB 240 240 HIS B 153 153 ARG A Protein S 5 FT #HET 26 26 ARG B 3 765 UMP B S 6 FT #HET 153 153 ARG B 1 767 UMP A A 10 FT #HET 154 154 ARG B 1 767 UMP A S 12 FT #HET 170 170 LEU B 3 765 UMP B S 1 FT #HET 173 173 CYS B 3 765 UMP B S 11 FT #HET 174 174 HIS B 3 765 UMP B S 1 FT #HET 199 199 ARG B 3 765 UMP B S 9 FT #HET 200 200 SER B 3 765 UMP B A 10 FT #HET 201 201 CYS B 3 765 UMP B B 2 FT #HET 202 202 ASP B 3 765 UMP B A 3 FT #HET 206 206 GLY B 3 765 UMP B B 2 FT #HET 210 210 ASN B 3 765 UMP B S 5 FT #HET 240 240 HIS B 3 765 UMP B S 7 FT #HET 242 242 TYR B 3 765 UMP B S 1 FT DISORDER 1 2 FT DISORDER 186 188 CC SEQUENCE 292 AA (ATOM); CC NAEEQQYLNL VQYIINHGED RPDRTGTGTL SVFAPSPLKF SLRNKTFPLL TTKRVFIRGV CC IEELLWFIRG ETDSLKLREK NIHIWDANGS REYLDSIGLT KRQEGDLGPI YGFQWRHFGA CC EYIDCKTNYI GQGVDQLANI IQKIRTSPYD RRLILSAWNP ADLEKMALPP CHMFCQFYVH CC IPSRPELSCQ LYQRSCDMGL GVPFNIASYA LLTCMIAHVC DLDPGDFIHV MGDCHIYKDH CC IEALQQQLTR SPRPFPTLSL NRSITDIEDF TLDDFNIQNY HPYETIKMKM SI CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MVNAEEQQYLNLVQYIINHGEDRPDRTGTGTLSVFAPSPLKFSLRNKTFP CC ATOM --NAEEQQYLNLVQYIINHGEDRPDRTGTGTLSVFAPSPLKFSLRNKTFP CC ************************************************ CC SEQRES LLTTKRVFIRGVIEELLWFIRGETDSLKLREKNIHIWDANGSREYLDSIG CC ATOM LLTTKRVFIRGVIEELLWFIRGETDSLKLREKNIHIWDANGSREYLDSIG CC ************************************************** CC SEQRES LTKRQEGDLGPIYGFQWRHFGAEYIDCKTNYIGQGVDQLANIIQKIRTSP CC ATOM LTKRQEGDLGPIYGFQWRHFGAEYIDCKTNYIGQGVDQLANIIQKIRTSP CC ************************************************** CC SEQRES YDRRLILSAWNPADLEKMALPPCHMFCQFYVHIPSNNHRPELSCQLYQRS CC ATOM YDRRLILSAWNPADLEKMALPPCHMFCQFYVHIPS---RPELSCQLYQRS CC *********************************** ************ CC SEQRES CDMGLGVPFNIASYALLTCMIAHVCDLDPGDFIHVMGDCHIYKDHIEALQ CC ATOM CDMGLGVPFNIASYALLTCMIAHVCDLDPGDFIHVMGDCHIYKDHIEALQ CC ************************************************** CC SEQRES QQLTRSPRPFPTLSLNRSITDIEDFTLDDFNIQNYHPYETIKMKMSI CC ATOM QQLTRSPRPFPTLSLNRSITDIEDFTLDDFNIQNYHPYETIKMKMSI CC *********************************************** SQ SEQUENCE 297 AA; MW; CN; MVNAEEQQYL NLVQYIINHG EDRPDRTGTG TLSVFAPSPL KFSLRNKTFP LLTTKRVFIR GVIEELLWFI RGETDSLKLR EKNIHIWDAN GSREYLDSIG LTKRQEGDLG PIYGFQWRHF GAEYIDCKTN YIGQGVDQLA NIIQKIRTSP YDRRLILSAW NPADLEKMAL PPCHMFCQFY VHIPSNNHRP ELSCQLYQRS CDMGLGVPFN IASYALLTCM IAHVCDLDPG DFIHVMGDCH IYKDHIEALQ QQLTRSPRPF PTLSLNRSIT DIEDFTLDDF NIQNYHPYET IKMKMSI //