ID 1DQSA STANDARD; PRT; 393 AA. DT CONVERTED FROM PDB (SEQRES) 1DQS DE PROTEIN (3-DEHYDROQUINATE SYNTHASE) OS Emericella nidulans CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.174 FT #SUB 37 37 THR A 360 360 GLY B Protein S 1 FT #SUB 86 86 ARG A 90 90 ALA B Protein S 7 FT #SUB 86 86 ARG A 93 93 GLU B Protein S 5 FT #SUB 86 86 ARG A 94 94 ASP B Protein S 6 FT #SUB 90 90 ALA A 86 86 ARG B Protein A 6 FT #SUB 93 93 GLU A 86 86 ARG B Protein S 5 FT #SUB 93 93 GLU A 164 164 ILE B Protein S 6 FT #SUB 94 94 ASP A 86 86 ARG B Protein S 6 FT #SUB 97 97 LEU A 159 159 LEU B Protein A 2 FT #SUB 97 97 LEU A 163 163 LEU B Protein S 1 FT #SUB 97 97 LEU A 354 354 LEU B Protein A 2 FT #SUB 102 102 PRO A 353 353 ALA B Protein S 3 FT #SUB 102 102 PRO A 354 354 LEU B Protein S 2 FT #SUB 105 105 ARG A 259 259 ARG B Protein S 1 FT #SUB 105 105 ARG A 260 260 GLU B Protein S 5 FT #SUB 105 105 ARG A 356 356 LYS B Protein S 4 FT #SUB 106 106 ASP A 360 360 GLY B Protein S 2 FT #SUB 123 123 PHE A 127 127 THR B Protein S 2 FT #SUB 127 127 THR A 123 123 PHE B Protein S 3 FT #SUB 127 127 THR A 164 164 ILE B Protein A 5 FT #SUB 127 127 THR A 165 165 GLY B Protein A 9 FT #SUB 129 129 MET A 163 163 LEU B Protein A 4 FT #SUB 129 129 MET A 354 354 LEU B Protein S 1 FT #SUB 129 129 MET A 356 356 LYS B Protein A 7 FT #SUB 130 130 ARG A 152 152 LYS B Protein S 9 FT #SUB 130 130 ARG A 153 153 THR B Protein S 5 FT #SUB 130 130 ARG A 154 154 ALA B Protein S 1 FT #SUB 130 130 ARG A 162 162 ASN B Protein S 2 FT #SUB 130 130 ARG A 165 165 GLY B Protein A 4 FT #SUB 130 130 ARG A 166 166 ALA B Protein S 4 FT #SUB 130 130 ARG A 167 167 ILE B Protein S 1 FT #SUB 130 130 ARG A 356 356 LYS B Protein S 1 FT #SUB 152 152 LYS A 130 130 ARG B Protein S 10 FT #SUB 153 153 THR A 130 130 ARG B Protein B 5 FT #SUB 154 154 ALA A 130 130 ARG B Protein S 1 FT #SUB 159 159 LEU A 97 97 LEU B Protein S 1 FT #SUB 159 159 LEU A 98 98 SER B Protein S 1 FT #SUB 162 162 ASN A 130 130 ARG B Protein S 3 FT #SUB 163 163 LEU A 129 129 MET B Protein B 4 FT #SUB 164 164 ILE A 93 93 GLU B Protein S 5 FT #SUB 164 164 ILE A 127 127 THR B Protein A 5 FT #SUB 165 165 GLY A 127 127 THR B Protein B 8 FT #SUB 165 165 GLY A 130 130 ARG B Protein B 4 FT #SUB 166 166 ALA A 130 130 ARG B Protein B 4 FT #SUB 168 168 TRP A 259 259 ARG B Protein S 2 FT #SUB 259 259 ARG A 105 105 ARG B Protein B 1 FT #SUB 259 259 ARG A 168 168 TRP B Protein S 2 FT #SUB 260 260 GLU A 105 105 ARG B Protein A 5 FT #SUB 353 353 ALA A 102 102 PRO B Protein A 3 FT #SUB 354 354 LEU A 97 97 LEU B Protein S 2 FT #SUB 354 354 LEU A 102 102 PRO B Protein S 2 FT #SUB 354 354 LEU A 129 129 MET B Protein B 1 FT #SUB 356 356 LYS A 105 105 ARG B Protein B 4 FT #SUB 356 356 LYS A 129 129 MET B Protein S 7 FT #SUB 356 356 LYS A 130 130 ARG B Protein S 1 FT #SUB 360 360 GLY A 37 37 THR B Protein B 1 FT #SUB 360 360 GLY A 106 106 ASP B Protein B 2 FT #HET 44 44 ASP A 3 400 NAD A S 4 FT #HET 46 46 ASN A 3 400 NAD A S 6 FT #HET 47 47 ILE A 3 400 NAD A S 8 FT #HET 79 79 PRO A 3 400 NAD A S 1 FT #HET 81 81 GLU A 3 400 NAD A S 4 FT #HET 84 84 LYS A 3 400 NAD A S 7 FT #HET 89 89 LYS A 2 403 CL A S 2 FT #HET 114 114 GLY A 3 400 NAD A B 6 FT #HET 115 115 GLY A 3 400 NAD A B 12 FT #HET 116 116 VAL A 3 400 NAD A A 13 FT #HET 119 119 ASP A 3 400 NAD A S 9 FT #HET 123 123 PHE A 2 403 CL A S 1 FT #HET 130 130 ARG A 7 401 CRB B S 8 FT #HET 139 139 THR A 3 400 NAD A A 11 FT #HET 140 140 THR A 3 400 NAD A S 7 FT #HET 142 142 LEU A 3 400 NAD A S 6 FT #HET 146 146 ASP A 1 402 ZN A S 1 FT #HET 146 146 ASP A 3 400 NAD A S 5 FT #HET 146 146 ASP A 4 401 CRB A S 6 FT #HET 147 147 SER A 3 400 NAD A A 15 FT #HET 152 152 LYS A 3 400 NAD A A 3 FT #HET 152 152 LYS A 4 401 CRB A S 12 FT #HET 161 161 LYS A 3 400 NAD A S 5 FT #HET 162 162 ASN A 3 400 NAD A S 2 FT #HET 162 162 ASN A 4 401 CRB A S 5 FT #HET 179 179 PHE A 3 400 NAD A A 3 FT #HET 182 182 THR A 3 400 NAD A A 9 FT #HET 183 183 LEU A 3 400 NAD A A 5 FT #HET 184 184 PRO A 3 400 NAD A S 2 FT #HET 187 187 GLU A 3 400 NAD A S 8 FT #HET 190 190 ASN A 3 400 NAD A S 1 FT #HET 194 194 GLU A 1 402 ZN A S 3 FT #HET 194 194 GLU A 3 400 NAD A S 2 FT #HET 194 194 GLU A 4 401 CRB A S 3 FT #HET 197 197 LYS A 4 401 CRB A S 3 FT #HET 250 250 LYS A 3 400 NAD A S 1 FT #HET 250 250 LYS A 4 401 CRB A S 4 FT #HET 264 264 ARG A 4 401 CRB A S 10 FT #HET 267 267 LEU A 4 401 CRB A A 10 FT #HET 268 268 ASN A 4 401 CRB A A 8 FT #HET 271 271 HIS A 1 402 ZN A S 3 FT #HET 271 271 HIS A 4 401 CRB A S 10 FT #HET 275 275 HIS A 4 401 CRB A S 6 FT #HET 287 287 HIS A 1 402 ZN A S 3 FT #HET 287 287 HIS A 3 400 NAD A S 5 FT #HET 287 287 HIS A 4 401 CRB A S 2 FT #HET 356 356 LYS A 4 401 CRB A S 4 FT DISORDER 1 3 FT DISORDER 224 230 FT DISORDER 392 393 CC SEQUENCE 381 AA (ATOM); CC PTKISILGRE SIIADFGLWR NYVAKDLISD CSSTTYVLVT DTNIGSIYTP SFEEAFRKRA CC AEITPSPRLL IYNRPPGEVS KSRQTKADIE DWMLSQNPPC GRDTVVIALG GGVIGDLTGF CC VASTYMRGVR YVQVPTTLLA MVDSSIGGKT AIDTPLGKNL IGAIWQPTKI YIDLEFLETL CC PVREFINGMA EVIKTAAISS EEEFTALEEN AETILKAVRR RFEGTEEILK ARILASARHK CC AYVVSADERE GGLRNLLNWG HSIGHAIEAI LTPQILHGEC VAIGMVKEAE LARHLGILKG CC VAVSRIVKCL AAYGLPTSLK DARIRKLTAG KHCSVDQLMF NMALDKKNDG PKKKIVLLSA CC IGTPYETRAS VVANEDIRVV L CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MSNPTKISILGRESIIADFGLWRNYVAKDLISDCSSTTYVLVTDTNIGSI CC ATOM ---PTKISILGRESIIADFGLWRNYVAKDLISDCSSTTYVLVTDTNIGSI 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 ISSEEEFTALEENAETILKAVRR-------RFEGTEEILKARILASARHK CC *********************** ******************** CC SEQRES AYVVSADEREGGLRNLLNWGHSIGHAIEAILTPQILHGECVAIGMVKEAE CC ATOM AYVVSADEREGGLRNLLNWGHSIGHAIEAILTPQILHGECVAIGMVKEAE CC ************************************************** CC SEQRES LARHLGILKGVAVSRIVKCLAAYGLPTSLKDARIRKLTAGKHCSVDQLMF CC ATOM LARHLGILKGVAVSRIVKCLAAYGLPTSLKDARIRKLTAGKHCSVDQLMF CC ************************************************** CC SEQRES NMALDKKNDGPKKKIVLLSAIGTPYETRASVVANEDIRVVLAP CC ATOM NMALDKKNDGPKKKIVLLSAIGTPYETRASVVANEDIRVVL-- 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 1DQSB STANDARD; PRT; 393 AA. DT CONVERTED FROM PDB (SEQRES) 1DQS DE PROTEIN (3-DEHYDROQUINATE SYNTHASE) OS Emericella nidulans CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.800 CC R-Factor 0.174 FT #SUB 37 37 THR B 360 360 GLY A Protein S 1 FT #SUB 86 86 ARG B 90 90 ALA A Protein S 6 FT #SUB 86 86 ARG B 93 93 GLU A Protein S 5 FT #SUB 86 86 ARG B 94 94 ASP A Protein S 6 FT #SUB 90 90 ALA B 86 86 ARG A Protein A 7 FT #SUB 93 93 GLU B 86 86 ARG A Protein S 5 FT #SUB 93 93 GLU B 164 164 ILE A Protein S 5 FT #SUB 94 94 ASP B 86 86 ARG A Protein S 6 FT #SUB 97 97 LEU B 159 159 LEU A Protein S 1 FT #SUB 97 97 LEU B 354 354 LEU A Protein A 2 FT #SUB 98 98 SER B 159 159 LEU A Protein S 1 FT #SUB 102 102 PRO B 353 353 ALA A Protein S 3 FT #SUB 102 102 PRO B 354 354 LEU A Protein S 2 FT #SUB 105 105 ARG B 259 259 ARG A Protein S 1 FT #SUB 105 105 ARG B 260 260 GLU A Protein S 5 FT #SUB 105 105 ARG B 356 356 LYS A Protein S 4 FT #SUB 106 106 ASP B 360 360 GLY A Protein S 2 FT #SUB 123 123 PHE B 127 127 THR A Protein S 3 FT #SUB 127 127 THR B 123 123 PHE A Protein S 2 FT #SUB 127 127 THR B 164 164 ILE A Protein A 5 FT #SUB 127 127 THR B 165 165 GLY A Protein A 8 FT #SUB 129 129 MET B 163 163 LEU A Protein A 4 FT #SUB 129 129 MET B 354 354 LEU A Protein S 1 FT #SUB 129 129 MET B 356 356 LYS A Protein A 7 FT #SUB 130 130 ARG B 152 152 LYS A Protein S 10 FT #SUB 130 130 ARG B 153 153 THR A Protein S 5 FT #SUB 130 130 ARG B 154 154 ALA A Protein S 1 FT #SUB 130 130 ARG B 162 162 ASN A Protein S 3 FT #SUB 130 130 ARG B 165 165 GLY A Protein A 4 FT #SUB 130 130 ARG B 166 166 ALA A Protein S 4 FT #SUB 130 130 ARG B 356 356 LYS A Protein S 1 FT #SUB 152 152 LYS B 130 130 ARG A Protein S 9 FT #SUB 153 153 THR B 130 130 ARG A Protein B 5 FT #SUB 154 154 ALA B 130 130 ARG A Protein S 1 FT #SUB 159 159 LEU B 97 97 LEU A Protein S 2 FT #SUB 162 162 ASN B 130 130 ARG A Protein S 2 FT #SUB 163 163 LEU B 97 97 LEU A Protein S 1 FT #SUB 163 163 LEU B 129 129 MET A Protein B 4 FT #SUB 164 164 ILE B 93 93 GLU A Protein S 6 FT #SUB 164 164 ILE B 127 127 THR A Protein A 5 FT #SUB 165 165 GLY B 127 127 THR A Protein B 9 FT #SUB 165 165 GLY B 130 130 ARG A Protein B 4 FT #SUB 166 166 ALA B 130 130 ARG A Protein B 4 FT #SUB 167 167 ILE B 130 130 ARG A Protein S 1 FT #SUB 168 168 TRP B 259 259 ARG A Protein S 2 FT #SUB 259 259 ARG B 105 105 ARG A Protein B 1 FT #SUB 259 259 ARG B 168 168 TRP A Protein S 2 FT #SUB 260 260 GLU B 105 105 ARG A Protein A 5 FT #SUB 353 353 ALA B 102 102 PRO A Protein A 3 FT #SUB 354 354 LEU B 97 97 LEU A Protein S 2 FT #SUB 354 354 LEU B 102 102 PRO A Protein S 2 FT #SUB 354 354 LEU B 129 129 MET A Protein B 1 FT #SUB 356 356 LYS B 105 105 ARG A Protein B 4 FT #SUB 356 356 LYS B 129 129 MET A Protein S 7 FT #SUB 356 356 LYS B 130 130 ARG A Protein S 1 FT #SUB 360 360 GLY B 37 37 THR A Protein B 1 FT #SUB 360 360 GLY B 106 106 ASP A Protein B 2 FT #HET 44 44 ASP B 6 400 NAD B S 4 FT #HET 46 46 ASN B 6 400 NAD B S 5 FT #HET 47 47 ILE B 6 400 NAD B S 5 FT #HET 79 79 PRO B 6 400 NAD B S 1 FT #HET 80 80 GLY B 6 400 NAD B B 1 FT #HET 81 81 GLU B 6 400 NAD B S 4 FT #HET 84 84 LYS B 6 400 NAD B S 7 FT #HET 89 89 LYS B 2 403 CL A S 2 FT #HET 114 114 GLY B 6 400 NAD B B 6 FT #HET 115 115 GLY B 6 400 NAD B B 13 FT #HET 116 116 VAL B 6 400 NAD B A 11 FT #HET 119 119 ASP B 6 400 NAD B S 9 FT #HET 123 123 PHE B 2 403 CL A S 1 FT #HET 130 130 ARG B 4 401 CRB A S 9 FT #HET 139 139 THR B 6 400 NAD B A 10 FT #HET 140 140 THR B 6 400 NAD B S 7 FT #HET 142 142 LEU B 6 400 NAD B S 5 FT #HET 146 146 ASP B 5 402 ZN B S 1 FT #HET 146 146 ASP B 6 400 NAD B S 5 FT #HET 146 146 ASP B 7 401 CRB B S 6 FT #HET 147 147 SER B 6 400 NAD B A 14 FT #HET 152 152 LYS B 6 400 NAD B A 3 FT #HET 152 152 LYS B 7 401 CRB B S 12 FT #HET 161 161 LYS B 6 400 NAD B S 5 FT #HET 162 162 ASN B 6 400 NAD B S 2 FT #HET 162 162 ASN B 7 401 CRB B S 5 FT #HET 179 179 PHE B 6 400 NAD B A 4 FT #HET 182 182 THR B 6 400 NAD B A 9 FT #HET 183 183 LEU B 6 400 NAD B A 7 FT #HET 184 184 PRO B 6 400 NAD B S 2 FT #HET 187 187 GLU B 6 400 NAD B S 9 FT #HET 190 190 ASN B 6 400 NAD B S 1 FT #HET 194 194 GLU B 5 402 ZN B S 3 FT #HET 194 194 GLU B 6 400 NAD B S 2 FT #HET 194 194 GLU B 7 401 CRB B S 4 FT #HET 197 197 LYS B 7 401 CRB B S 3 FT #HET 250 250 LYS B 6 400 NAD B S 1 FT #HET 250 250 LYS B 7 401 CRB B S 2 FT #HET 264 264 ARG B 7 401 CRB B S 10 FT #HET 267 267 LEU B 7 401 CRB B A 11 FT #HET 268 268 ASN B 7 401 CRB B A 8 FT #HET 271 271 HIS B 5 402 ZN B S 3 FT #HET 271 271 HIS B 7 401 CRB B S 8 FT #HET 275 275 HIS B 7 401 CRB B S 4 FT #HET 287 287 HIS B 5 402 ZN B S 3 FT #HET 287 287 HIS B 6 400 NAD B S 4 FT #HET 287 287 HIS B 7 401 CRB B S 2 FT #HET 356 356 LYS B 7 401 CRB B S 4 FT DISORDER 1 2 FT DISORDER 224 234 CC SEQUENCE 380 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 RTEEILKARI LASARHKAYV CC VSADEREGGL RNLLNWGHSI GHAIEAILTP QILHGECVAI GMVKEAELAR HLGILKGVAV CC SRIVKCLAAY GLPTSLKDAR IRKLTAGKHC SVDQLMFNMA LDKKNDGPKK KIVLLSAIGT CC PYETRASVVA NEDIRVVLAP 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 ISSEEEFTALEENAETILKAVRR-----------TEEILKARILASARHK 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 //