ID 3W7FA STANDARD; PRT; 293 AA. DT CONVERTED FROM PDB (SEQRES) 3W7F DE Dehydrosqualene synthase OS Staphylococcus aureus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.250 CC R-Factor 0.206 FT #SUB 15 9 LYS A 184 178 GLU B Protein S 1 FT #SUB 15 9 LYS A 186 180 GLU B Protein S 1 FT #SUB 19 13 LYS A 185 179 ASN B Protein S 3 FT #SUB 22 16 LYS A 184 178 GLU B Protein S 4 FT #SUB 23 17 LYS A 181 175 GLU B Protein S 4 FT #SUB 58 52 ASP A 19 13 LYS B Protein B 2 FT #SUB 59 53 VAL A 24 18 HIS B Protein S 2 FT #SUB 184 178 GLU A 22 16 LYS B Protein S 2 FT #SUB 185 179 ASN A 19 13 LYS B Protein S 1 FT #SUB 269 263 HIS A 276 270 LYS B Protein B 3 FT #SUB 273 267 PHE A 273 267 PHE B Protein S 2 FT #SUB 276 270 LYS A 269 263 HIS B Protein S 1 FT #HET 21 15 MET A 1 301 FPS A S 1 FT #HET 24 18 HIS A 2 302 FPS A B 4 FT #HET 25 19 SER A 2 302 FPS A A 8 FT #HET 26 20 LYS A 2 302 FPS A A 4 FT #HET 27 21 SER A 2 302 FPS A A 6 FT #HET 28 22 PHE A 1 301 FPS A S 1 FT #HET 28 22 PHE A 2 302 FPS A S 4 FT #HET 47 41 TYR A 1 301 FPS A S 10 FT #HET 47 41 TYR A 2 302 FPS A S 4 FT #HET 50 44 CYS A 1 301 FPS A A 5 FT #HET 51 45 ARG A 1 301 FPS A A 12 FT #HET 51 45 ARG A 2 302 FPS A S 3 FT #HET 54 48 ASP A 1 301 FPS A S 8 FT #HET 54 48 ASP A 5 305 MG A S 3 FT #HET 58 52 ASP A 5 305 MG A S 2 FT #HET 139 133 VAL A 1 301 FPS A B 1 FT #HET 140 134 ALA A 2 302 FPS A A 3 FT #HET 143 137 VAL A 1 301 FPS A S 1 FT #HET 144 138 GLY A 2 302 FPS A B 3 FT #HET 147 141 LEU A 1 301 FPS A S 1 FT #HET 147 141 LEU A 2 302 FPS A S 1 FT #HET 151 145 LEU A 2 302 FPS A S 1 FT #HET 163 157 ALA A 2 302 FPS A A 3 FT #HET 166 160 LEU A 2 302 FPS A S 2 FT #HET 167 161 GLY A 2 302 FPS A B 4 FT #HET 170 164 LEU A 2 302 FPS A S 2 FT #HET 171 165 GLN A 2 302 FPS A A 2 FT #HET 174 168 ASN A 1 301 FPS A S 8 FT #HET 174 168 ASN A 2 302 FPS A S 4 FT #HET 174 168 ASN A 3 303 MG A S 3 FT #HET 177 171 ARG A 1 301 FPS A S 2 FT #HET 177 171 ARG A 2 302 FPS A S 6 FT #HET 178 172 ASP A 1 301 FPS A S 2 FT #HET 178 172 ASP A 3 303 MG A S 3 FT #HET 182 176 ASP A 3 303 MG A S 1 FT #HET 239 233 PHE A 2 302 FPS A S 1 FT #HET 254 248 TYR A 2 302 FPS A S 7 FT #HET 271 265 ARG A 2 302 FPS A S 3 FT #HET 271 265 ARG A 4 304 MG A S 1 FT DISORDER 1 6 FT DISORDER 291 293 CC SEQUENCE 284 AA (ATOM); CC MTMMDMNFKY CHKIMKKHSK SFSYAFDLLP EDQRKAVWAI YAVCRKIDDS IDVYGDIQFL CC NQIKEDIQSI EKYPYEYHHF QSDRRIMMAL QHVAQHKNIA FQSFYNLIDT VYKDQHFTMF CC ETDAELFGYC YGVAGTVGEV LTPILSDHET HQTYDVARRL GESLQLINIL RDVGEDFENE CC RIYFSKQRLK QYEVDIAEVY QNGVNNHYID LWEYYAAIAE KDFRDVMDQI KVFSIEAQPI CC IELAARIYIE ILDEVRQANY TLHERVFVEK RKKAKLFHEI NSKY CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AAAAAAMTMMDMNFKYCHKIMKKHSKSFSYAFDLLPEDQRKAVWAIYAVC CC ATOM ------MTMMDMNFKYCHKIMKKHSKSFSYAFDLLPEDQRKAVWAIYAVC CC ******************************************** CC SEQRES RKIDDSIDVYGDIQFLNQIKEDIQSIEKYPYEYHHFQSDRRIMMALQHVA CC ATOM RKIDDSIDVYGDIQFLNQIKEDIQSIEKYPYEYHHFQSDRRIMMALQHVA CC ************************************************** CC SEQRES QHKNIAFQSFYNLIDTVYKDQHFTMFETDAELFGYCYGVAGTVGEVLTPI CC ATOM QHKNIAFQSFYNLIDTVYKDQHFTMFETDAELFGYCYGVAGTVGEVLTPI CC ************************************************** CC SEQRES LSDHETHQTYDVARRLGESLQLINILRDVGEDFENERIYFSKQRLKQYEV CC ATOM LSDHETHQTYDVARRLGESLQLINILRDVGEDFENERIYFSKQRLKQYEV CC ************************************************** CC SEQRES DIAEVYQNGVNNHYIDLWEYYAAIAEKDFRDVMDQIKVFSIEAQPIIELA CC ATOM DIAEVYQNGVNNHYIDLWEYYAAIAEKDFRDVMDQIKVFSIEAQPIIELA CC ************************************************** CC SEQRES ARIYIEILDEVRQANYTLHERVFVEKRKKAKLFHEINSKYHRI CC ATOM ARIYIEILDEVRQANYTLHERVFVEKRKKAKLFHEINSKY--- CC **************************************** SQ SEQUENCE 293 AA; MW; CN; AAAAAAMTMM DMNFKYCHKI MKKHSKSFSY AFDLLPEDQR KAVWAIYAVC RKIDDSIDVY GDIQFLNQIK EDIQSIEKYP YEYHHFQSDR RIMMALQHVA QHKNIAFQSF YNLIDTVYKD QHFTMFETDA ELFGYCYGVA GTVGEVLTPI LSDHETHQTY DVARRLGESL QLINILRDVG EDFENERIYF SKQRLKQYEV DIAEVYQNGV NNHYIDLWEY YAAIAEKDFR DVMDQIKVFS IEAQPIIELA ARIYIEILDE VRQANYTLHE RVFVEKRKKA KLFHEINSKY HRI // ID 3W7FB STANDARD; PRT; 293 AA. DT CONVERTED FROM PDB (SEQRES) 3W7F DE Dehydrosqualene synthase OS Staphylococcus aureus CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.250 CC R-Factor 0.206 FT #SUB 19 13 LYS B 58 52 ASP A Protein S 2 FT #SUB 19 13 LYS B 185 179 ASN A Protein S 1 FT #SUB 22 16 LYS B 184 178 GLU A Protein S 2 FT #SUB 24 18 HIS B 59 53 VAL A Protein S 2 FT #SUB 181 175 GLU B 23 17 LYS A Protein S 4 FT #SUB 184 178 GLU B 15 9 LYS A Protein B 1 FT #SUB 184 178 GLU B 22 16 LYS A Protein S 4 FT #SUB 185 179 ASN B 19 13 LYS A Protein S 3 FT #SUB 186 180 GLU B 15 9 LYS A Protein S 1 FT #SUB 269 263 HIS B 276 270 LYS A Protein B 1 FT #SUB 273 267 PHE B 273 267 PHE A Protein S 2 FT #SUB 276 270 LYS B 269 263 HIS A Protein S 3 FT #HET 24 18 HIS B 7 302 FPS B B 3 FT #HET 25 19 SER B 7 302 FPS B A 8 FT #HET 26 20 LYS B 7 302 FPS B A 4 FT #HET 27 21 SER B 7 302 FPS B A 5 FT #HET 28 22 PHE B 7 302 FPS B S 5 FT #HET 32 26 PHE B 6 301 FPS B S 1 FT #HET 32 26 PHE B 7 302 FPS B S 1 FT #HET 47 41 TYR B 6 301 FPS B A 12 FT #HET 47 41 TYR B 7 302 FPS B S 4 FT #HET 50 44 CYS B 6 301 FPS B A 4 FT #HET 51 45 ARG B 6 301 FPS B A 9 FT #HET 51 45 ARG B 7 302 FPS B S 2 FT #HET 54 48 ASP B 6 301 FPS B S 4 FT #HET 54 48 ASP B 10 305 MG B S 3 FT #HET 58 52 ASP B 6 301 FPS B S 1 FT #HET 58 52 ASP B 10 305 MG B S 2 FT #HET 139 133 VAL B 6 301 FPS B B 3 FT #HET 143 137 VAL B 6 301 FPS B S 3 FT #HET 143 137 VAL B 7 302 FPS B S 1 FT #HET 144 138 GLY B 7 302 FPS B B 2 FT #HET 147 141 LEU B 7 302 FPS B S 1 FT #HET 151 145 LEU B 7 302 FPS B S 1 FT #HET 163 157 ALA B 7 302 FPS B A 3 FT #HET 166 160 LEU B 7 302 FPS B S 5 FT #HET 167 161 GLY B 7 302 FPS B B 2 FT #HET 170 164 LEU B 7 302 FPS B S 3 FT #HET 171 165 GLN B 6 301 FPS B S 1 FT #HET 171 165 GLN B 7 302 FPS B S 1 FT #HET 174 168 ASN B 6 301 FPS B S 6 FT #HET 174 168 ASN B 7 302 FPS B S 2 FT #HET 174 168 ASN B 8 303 MG B A 4 FT #HET 177 171 ARG B 6 301 FPS B S 2 FT #HET 177 171 ARG B 7 302 FPS B S 7 FT #HET 178 172 ASP B 6 301 FPS B S 2 FT #HET 178 172 ASP B 8 303 MG B S 3 FT #HET 239 233 PHE B 7 302 FPS B S 2 FT #HET 254 248 TYR B 7 302 FPS B S 6 FT #HET 271 265 ARG B 7 302 FPS B S 3 FT DISORDER 1 6 FT DISORDER 291 293 CC SEQUENCE 284 AA (ATOM); CC MTMMDMNFKY CHKIMKKHSK SFSYAFDLLP EDQRKAVWAI YAVCRKIDDS IDVYGDIQFL CC NQIKEDIQSI EKYPYEYHHF QSDRRIMMAL QHVAQHKNIA FQSFYNLIDT VYKDQHFTMF CC ETDAELFGYC YGVAGTVGEV LTPILSDHET HQTYDVARRL GESLQLINIL RDVGEDFENE CC RIYFSKQRLK QYEVDIAEVY QNGVNNHYID LWEYYAAIAE KDFRDVMDQI KVFSIEAQPI CC IELAARIYIE ILDEVRQANY TLHERVFVEK RKKAKLFHEI NSKY CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES AAAAAAMTMMDMNFKYCHKIMKKHSKSFSYAFDLLPEDQRKAVWAIYAVC CC ATOM ------MTMMDMNFKYCHKIMKKHSKSFSYAFDLLPEDQRKAVWAIYAVC CC ******************************************** CC SEQRES RKIDDSIDVYGDIQFLNQIKEDIQSIEKYPYEYHHFQSDRRIMMALQHVA CC ATOM RKIDDSIDVYGDIQFLNQIKEDIQSIEKYPYEYHHFQSDRRIMMALQHVA CC ************************************************** CC SEQRES QHKNIAFQSFYNLIDTVYKDQHFTMFETDAELFGYCYGVAGTVGEVLTPI CC ATOM QHKNIAFQSFYNLIDTVYKDQHFTMFETDAELFGYCYGVAGTVGEVLTPI CC ************************************************** CC SEQRES LSDHETHQTYDVARRLGESLQLINILRDVGEDFENERIYFSKQRLKQYEV CC ATOM LSDHETHQTYDVARRLGESLQLINILRDVGEDFENERIYFSKQRLKQYEV CC ************************************************** CC SEQRES DIAEVYQNGVNNHYIDLWEYYAAIAEKDFRDVMDQIKVFSIEAQPIIELA CC ATOM DIAEVYQNGVNNHYIDLWEYYAAIAEKDFRDVMDQIKVFSIEAQPIIELA CC ************************************************** CC SEQRES ARIYIEILDEVRQANYTLHERVFVEKRKKAKLFHEINSKYHRI CC ATOM ARIYIEILDEVRQANYTLHERVFVEKRKKAKLFHEINSKY--- CC **************************************** SQ SEQUENCE 293 AA; MW; CN; AAAAAAMTMM DMNFKYCHKI MKKHSKSFSY AFDLLPEDQR KAVWAIYAVC RKIDDSIDVY GDIQFLNQIK EDIQSIEKYP YEYHHFQSDR RIMMALQHVA QHKNIAFQSF YNLIDTVYKD QHFTMFETDA ELFGYCYGVA GTVGEVLTPI LSDHETHQTY DVARRLGESL QLINILRDVG EDFENERIYF SKQRLKQYEV DIAEVYQNGV NNHYIDLWEY YAAIAEKDFR DVMDQIKVFS IEAQPIIELA ARIYIEILDE VRQANYTLHE RVFVEKRKKA KLFHEINSKY HRI //