ID 1NVBA STANDARD; PRT; 393 AA. DT CONVERTED FROM PDB (SEQRES) 1NVB DE 3-DEHYDROQUINATE SYNTHASE OS Emericella nidulans CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.216 FT #SUB 303 303 ARG A 300 300 GLU B Protein B 1 FT #SUB 303 303 ARG A 389 389 VAL B Protein S 2 FT #SUB 303 303 ARG A 390 390 VAL B Protein S 2 FT #SUB 303 303 ARG A 392 392 ALA B Protein S 6 FT #SUB 304 304 HIS A 328 328 SER B Protein S 4 FT #SUB 305 305 LEU A 317 317 VAL B Protein B 4 FT #SUB 306 306 GLY A 313 313 VAL B Protein B 1 FT #SUB 306 306 GLY A 314 314 SER B Protein B 3 FT #SUB 306 306 GLY A 317 317 VAL B Protein B 1 FT #SUB 307 307 ILE A 303 303 ARG B Protein B 1 FT #SUB 307 307 ILE A 314 314 SER B Protein S 1 FT #SUB 308 308 LEU A 303 303 ARG B Protein B 1 FT #SUB 309 309 LYS A 303 303 ARG B Protein A 15 FT #SUB 309 309 LYS A 304 304 HIS B Protein S 9 FT #SUB 311 311 VAL A 304 304 HIS B Protein S 1 FT #SUB 369 369 SER A 303 303 ARG B Protein B 3 FT #SUB 375 375 TYR A 314 314 SER B Protein S 1 FT #SUB 385 385 GLU A 332 332 ALA B Protein S 1 FT #SUB 389 389 VAL A 330 330 LYS B Protein S 4 FT #HET 44 44 ASP A 4 400 NAD A S 3 FT #HET 46 46 ASN A 4 400 NAD A S 3 FT #HET 47 47 ILE A 4 400 NAD A S 2 FT #HET 51 51 TYR A 4 400 NAD A S 1 FT #HET 81 81 GLU A 4 400 NAD A S 4 FT #HET 84 84 LYS A 4 400 NAD A S 3 FT #HET 105 105 ARG A 3 605 CL A S 3 FT #HET 114 114 GLY A 4 400 NAD A B 6 FT #HET 115 115 GLY A 4 400 NAD A B 11 FT #HET 116 116 VAL A 4 400 NAD A A 8 FT #HET 119 119 ASP A 4 400 NAD A S 11 FT #HET 129 129 MET A 3 605 CL A B 1 FT #HET 130 130 ARG A 3 605 CL A B 2 FT #HET 131 131 GLY A 3 605 CL A B 1 FT #HET 139 139 THR A 4 400 NAD A A 9 FT #HET 140 140 THR A 4 400 NAD A S 7 FT #HET 142 142 LEU A 4 400 NAD A S 2 FT #HET 146 146 ASP A 1 600 ZN A S 1 FT #HET 146 146 ASP A 4 400 NAD A S 4 FT #HET 146 146 ASP A 5 500 CRB A S 7 FT #HET 147 147 SER A 4 400 NAD A A 13 FT #HET 152 152 LYS A 4 400 NAD A A 6 FT #HET 152 152 LYS A 5 500 CRB A S 13 FT #HET 161 161 LYS A 4 400 NAD A S 5 FT #HET 162 162 ASN A 4 400 NAD A S 1 FT #HET 162 162 ASN A 5 500 CRB A S 4 FT #HET 179 179 PHE A 4 400 NAD A B 3 FT #HET 182 182 THR A 4 400 NAD A A 9 FT #HET 183 183 LEU A 4 400 NAD A B 3 FT #HET 184 184 PRO A 2 604 CL A B 1 FT #HET 184 184 PRO A 4 400 NAD A S 3 FT #HET 185 185 VAL A 2 604 CL A A 2 FT #HET 187 187 GLU A 4 400 NAD A S 6 FT #HET 190 190 ASN A 4 400 NAD A S 1 FT #HET 194 194 GLU A 1 600 ZN A S 3 FT #HET 194 194 GLU A 4 400 NAD A S 1 FT #HET 194 194 GLU A 5 500 CRB A S 3 FT #HET 197 197 LYS A 5 500 CRB A S 3 FT #HET 250 250 LYS A 5 500 CRB A S 4 FT #HET 264 264 ARG A 5 500 CRB A A 11 FT #HET 267 267 LEU A 5 500 CRB A A 10 FT #HET 268 268 ASN A 5 500 CRB A A 8 FT #HET 271 271 HIS A 1 600 ZN A S 3 FT #HET 271 271 HIS A 5 500 CRB A S 10 FT #HET 275 275 HIS A 5 500 CRB A S 6 FT #HET 287 287 HIS A 1 600 ZN A S 3 FT #HET 287 287 HIS A 4 400 NAD A S 4 FT #HET 287 287 HIS A 5 500 CRB A S 2 FT #HET 356 356 LYS A 5 500 CRB A S 5 FT DISORDER 1 2 FT DISORDER 393 393 CC Miss-BB 1 CC Miss-SC 1 CC SEQUENCE 390 AA (ATOM); CC NPTKISILGR ESIIADFGLW RNYVAKDLIS DCSSTTYVLV TDTNIGSIYT PSFEEAFRKR CC AAEITPSPRL LIYNRPPGEV SKSRQTKADI EDWMLSQNPP CGRDTVVIAL GGGVIGDLTG CC FVASTYMRGV RYVQVPTTLL AMVDSSIGGK TAIDTPLGKN LIGAIWQPTK IYIDLEFLET CC LPVREFINGM AEVIKTAAIS SEEEFTALEE NAETILKAVR REVTPGEHRF EGTEEILKAR CC ILASARHKAY VVSADEREGG LRNLLNWGHS IGHAIEAILT PQILHGECVA IGMVKEAELA CC RHLGILKGVA VSRIVKCLAA YGLPTSLKDA RIRKLTAGKH CSVDQLMFNM ALDKKNDGPK CC KKIVLLSAIG TPYETRASVV ANEDIRVVLA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSNPTKISILGRESIIADFGLWRNYVAKDLISDCSSTTYVLVTDTNIGSI CC ATOM --NPTKISILGRESIIADFGLWRNYVAKDLISDCSSTTYVLVTDTNIGSI CC ************************************************ CC SEQRES YTPSFEEAFRKRAAEITPSPRLLIYNRPPGEVSKSRQTKADIEDWMLSQN CC ATOM YTPSFEEAFRKRAAEITPSPRLLIYNRPPGEVSKSRQTKADIEDWMLSQN CC ************************************************** CC SEQRES PPCGRDTVVIALGGGVIGDLTGFVASTYMRGVRYVQVPTTLLAMVDSSIG CC ATOM PPCGRDTVVIALGGGVIGDLTGFVASTYMRGVRYVQVPTTLLAMVDSSIG CC ************************************************** CC SEQRES GKTAIDTPLGKNLIGAIWQPTKIYIDLEFLETLPVREFINGMAEVIKTAA CC ATOM GKTAIDTPLGKNLIGAIWQPTKIYIDLEFLETLPVREFINGMAEVIKTAA CC ************************************************** CC SEQRES ISSEEEFTALEENAETILKAVRREVTPGEHRFEGTEEILKARILASARHK CC ATOM ISSEEEFTALEENAETILKAVRREVTPGEHRFEGTEEILKARILASARHK CC ************************************************** CC SEQRES AYVVSADEREGGLRNLLNWGHSIGHAIEAILTPQILHGECVAIGMVKEAE CC ATOM AYVVSADEREGGLRNLLNWGHSIGHAIEAILTPQILHGECVAIGMVKEAE CC ************************************************** CC SEQRES LARHLGILKGVAVSRIVKCLAAYGLPTSLKDARIRKLTAGKHCSVDQLMF CC ATOM LARHLGILKGVAVSRIVKCLAAYGLPTSLKDARIRKLTAGKHCSVDQLMF CC ************************************************** CC SEQRES NMALDKKNDGPKKKIVLLSAIGTPYETRASVVANEDIRVVLAP CC ATOM NMALDKKNDGPKKKIVLLSAIGTPYETRASVVANEDIRVVLA- CC ****************************************** SQ SEQUENCE 393 AA; MW; CN; MSNPTKISIL GRESIIADFG LWRNYVAKDL ISDCSSTTYV LVTDTNIGSI YTPSFEEAFR KRAAEITPSP RLLIYNRPPG EVSKSRQTKA DIEDWMLSQN PPCGRDTVVI ALGGGVIGDL TGFVASTYMR GVRYVQVPTT LLAMVDSSIG GKTAIDTPLG KNLIGAIWQP TKIYIDLEFL ETLPVREFIN GMAEVIKTAA ISSEEEFTAL EENAETILKA VRREVTPGEH RFEGTEEILK ARILASARHK AYVVSADERE GGLRNLLNWG HSIGHAIEAI LTPQILHGEC VAIGMVKEAE LARHLGILKG VAVSRIVKCL AAYGLPTSLK DARIRKLTAG KHCSVDQLMF NMALDKKNDG PKKKIVLLSA IGTPYETRAS VVANEDIRVV LAP // ID 1NVBB STANDARD; PRT; 393 AA. DT CONVERTED FROM PDB (SEQRES) 1NVB DE 3-DEHYDROQUINATE SYNTHASE OS Emericella nidulans CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.700 CC R-Factor 0.216 FT #SUB 300 300 GLU B 303 303 ARG A Protein S 1 FT #SUB 303 303 ARG B 307 307 ILE A Protein S 1 FT #SUB 303 303 ARG B 308 308 LEU A Protein S 1 FT #SUB 303 303 ARG B 309 309 LYS A Protein A 15 FT #SUB 303 303 ARG B 369 369 SER A Protein S 3 FT #SUB 304 304 HIS B 309 309 LYS A Protein A 9 FT #SUB 304 304 HIS B 311 311 VAL A Protein S 1 FT #SUB 313 313 VAL B 306 306 GLY A Protein S 1 FT #SUB 314 314 SER B 306 306 GLY A Protein A 3 FT #SUB 314 314 SER B 307 307 ILE A Protein S 1 FT #SUB 314 314 SER B 375 375 TYR A Protein S 1 FT #SUB 317 317 VAL B 305 305 LEU A Protein S 4 FT #SUB 317 317 VAL B 306 306 GLY A Protein S 1 FT #SUB 328 328 SER B 304 304 HIS A Protein S 4 FT #SUB 330 330 LYS B 389 389 VAL A Protein A 4 FT #SUB 332 332 ALA B 385 385 GLU A Protein S 1 FT #SUB 389 389 VAL B 303 303 ARG A Protein B 2 FT #SUB 390 390 VAL B 303 303 ARG A Protein B 2 FT #SUB 392 392 ALA B 303 303 ARG A Protein A 6 FT #HET 146 146 ASP B 6 601 ZN B S 1 FT #HET 146 146 ASP B 7 501 CRB B S 7 FT #HET 152 152 LYS B 7 501 CRB B S 15 FT #HET 162 162 ASN B 7 501 CRB B S 4 FT #HET 194 194 GLU B 6 601 ZN B S 3 FT #HET 194 194 GLU B 7 501 CRB B S 3 FT #HET 197 197 LYS B 7 501 CRB B S 3 FT #HET 250 250 LYS B 7 501 CRB B S 3 FT #HET 264 264 ARG B 7 501 CRB B A 12 FT #HET 267 267 LEU B 7 501 CRB B A 9 FT #HET 268 268 ASN B 7 501 CRB B A 9 FT #HET 271 271 HIS B 6 601 ZN B S 3 FT #HET 271 271 HIS B 7 501 CRB B S 8 FT #HET 275 275 HIS B 7 501 CRB B S 4 FT #HET 287 287 HIS B 6 601 ZN B S 3 FT #HET 287 287 HIS B 7 501 CRB B S 1 FT #HET 356 356 LYS B 7 501 CRB B S 6 FT DISORDER 1 2 CC SEQUENCE 391 AA (ATOM); CC NPTKISILGR ESIIADFGLW RNYVAKDLIS DCSSTTYVLV TDTNIGSIYT PSFEEAFRKR CC AAEITPSPRL LIYNRPPGEV SKSRQTKADI EDWMLSQNPP CGRDTVVIAL GGGVIGDLTG CC FVASTYMRGV RYVQVPTTLL AMVDSSIGGK TAIDTPLGKN LIGAIWQPTK IYIDLEFLET CC LPVREFINGM AEVIKTAAIS SEEEFTALEE NAETILKAVR REVTPGEHRF EGTEEILKAR CC ILASARHKAY VVSADEREGG LRNLLNWGHS IGHAIEAILT PQILHGECVA IGMVKEAELA CC RHLGILKGVA VSRIVKCLAA YGLPTSLKDA RIRKLTAGKH CSVDQLMFNM ALDKKNDGPK CC KKIVLLSAIG TPYETRASVV ANEDIRVVLA P CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSNPTKISILGRESIIADFGLWRNYVAKDLISDCSSTTYVLVTDTNIGSI CC ATOM --NPTKISILGRESIIADFGLWRNYVAKDLISDCSSTTYVLVTDTNIGSI CC ************************************************ CC SEQRES YTPSFEEAFRKRAAEITPSPRLLIYNRPPGEVSKSRQTKADIEDWMLSQN CC ATOM YTPSFEEAFRKRAAEITPSPRLLIYNRPPGEVSKSRQTKADIEDWMLSQN CC ************************************************** CC SEQRES PPCGRDTVVIALGGGVIGDLTGFVASTYMRGVRYVQVPTTLLAMVDSSIG CC ATOM PPCGRDTVVIALGGGVIGDLTGFVASTYMRGVRYVQVPTTLLAMVDSSIG CC ************************************************** CC SEQRES GKTAIDTPLGKNLIGAIWQPTKIYIDLEFLETLPVREFINGMAEVIKTAA CC ATOM GKTAIDTPLGKNLIGAIWQPTKIYIDLEFLETLPVREFINGMAEVIKTAA CC ************************************************** CC SEQRES ISSEEEFTALEENAETILKAVRREVTPGEHRFEGTEEILKARILASARHK CC ATOM ISSEEEFTALEENAETILKAVRREVTPGEHRFEGTEEILKARILASARHK CC ************************************************** CC SEQRES AYVVSADEREGGLRNLLNWGHSIGHAIEAILTPQILHGECVAIGMVKEAE CC ATOM AYVVSADEREGGLRNLLNWGHSIGHAIEAILTPQILHGECVAIGMVKEAE CC ************************************************** CC SEQRES LARHLGILKGVAVSRIVKCLAAYGLPTSLKDARIRKLTAGKHCSVDQLMF CC ATOM LARHLGILKGVAVSRIVKCLAAYGLPTSLKDARIRKLTAGKHCSVDQLMF CC ************************************************** CC SEQRES NMALDKKNDGPKKKIVLLSAIGTPYETRASVVANEDIRVVLAP CC ATOM NMALDKKNDGPKKKIVLLSAIGTPYETRASVVANEDIRVVLAP CC ******************************************* SQ SEQUENCE 393 AA; MW; CN; MSNPTKISIL GRESIIADFG LWRNYVAKDL ISDCSSTTYV LVTDTNIGSI YTPSFEEAFR KRAAEITPSP RLLIYNRPPG EVSKSRQTKA DIEDWMLSQN PPCGRDTVVI ALGGGVIGDL TGFVASTYMR GVRYVQVPTT LLAMVDSSIG GKTAIDTPLG KNLIGAIWQP TKIYIDLEFL ETLPVREFIN GMAEVIKTAA ISSEEEFTAL EENAETILKA VRREVTPGEH RFEGTEEILK ARILASARHK AYVVSADERE GGLRNLLNWG HSIGHAIEAI LTPQILHGEC VAIGMVKEAE LARHLGILKG VAVSRIVKCL AAYGLPTSLK DARIRKLTAG KHCSVDQLMF NMALDKKNDG PKKKIVLLSA IGTPYETRAS VVANEDIRVV LAP //