ID 4UMBA STANDARD; PRT; 351 AA. DT CONVERTED FROM PDB (SEQRES) 4UMB DE PHOSPHO-2-DEHYDRO-3-DEOXYHEPTONATE ALDOLASE OS NEISSERIA MENINGITIDIS CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.170 CC R-Factor 0.202 FT #SUB 16 16 LYS A 222 222 ILE B Protein B 4 FT #SUB 18 18 LEU A 212 212 LEU B Protein S 2 FT #SUB 18 18 LEU A 220 220 SER B Protein S 3 FT #SUB 18 18 LEU A 221 221 ALA B Protein S 3 FT #SUB 99 99 LYS A 172 172 GLN B Protein B 4 FT #SUB 100 100 PRO A 172 172 GLN B Protein B 4 FT #SUB 101 101 ARG A 172 172 GLN B Protein A 6 FT #SUB 101 101 ARG A 175 175 ARG B Protein B 1 FT #SUB 102 102 THR A 175 175 ARG B Protein B 4 FT #SUB 102 102 THR A 200 200 ASP B Protein A 3 FT #SUB 103 103 THR A 200 200 ASP B Protein S 4 FT #SUB 103 103 THR A 204 204 ALA B Protein B 1 FT #SUB 104 104 VAL A 207 207 HIS B Protein S 1 FT #SUB 107 107 LYS A 172 172 GLN B Protein S 4 FT #SUB 107 107 LYS A 176 176 GLU B Protein S 5 FT #SUB 107 107 LYS A 209 209 HIS B Protein S 5 FT #SUB 107 107 LYS A 210 210 HIS B Protein S 1 FT #SUB 111 111 ASN A 210 210 HIS B Protein S 4 FT #SUB 119 119 PHE A 210 210 HIS B Protein S 20 FT #SUB 147 147 LEU A 172 172 GLN B Protein S 1 FT #SUB 147 147 LEU A 173 173 VAL B Protein B 1 FT #SUB 149 149 MET A 149 149 MET B Protein S 1 FT #SUB 150 150 ILE A 212 212 LEU B Protein S 2 FT #SUB 151 151 THR A 212 212 LEU B Protein S 1 FT #SUB 167 167 ARG A 170 170 GLU B Protein A 8 FT #SUB 167 167 ARG A 171 171 SER B Protein B 2 FT #SUB 168 168 THR A 171 171 SER B Protein S 3 FT #SUB 170 170 GLU A 167 167 ARG B Protein A 7 FT #SUB 170 170 GLU A 191 191 THR B Protein S 5 FT #SUB 171 171 SER A 167 167 ARG B Protein B 2 FT #SUB 171 171 SER A 168 168 THR B Protein A 3 FT #SUB 171 171 SER A 174 174 HIS B Protein S 1 FT #SUB 172 172 GLN A 99 99 LYS B Protein S 4 FT #SUB 172 172 GLN A 100 100 PRO B Protein S 4 FT #SUB 172 172 GLN A 101 101 ARG B Protein S 6 FT #SUB 172 172 GLN A 107 107 LYS B Protein S 4 FT #SUB 172 172 GLN A 147 147 LEU B Protein S 1 FT #SUB 173 173 VAL A 147 147 LEU B Protein S 1 FT #SUB 173 173 VAL A 174 174 HIS B Protein S 1 FT #SUB 174 174 HIS A 171 171 SER B Protein S 1 FT #SUB 174 174 HIS A 173 173 VAL B Protein S 1 FT #SUB 175 175 ARG A 101 101 ARG B Protein S 1 FT #SUB 175 175 ARG A 102 102 THR B Protein S 4 FT #SUB 176 176 GLU A 107 107 LYS B Protein S 5 FT #SUB 191 191 THR A 170 170 GLU B Protein S 5 FT #SUB 192 192 ASP A 194 194 ASN B Protein S 5 FT #SUB 194 194 ASN A 192 192 ASP B Protein S 5 FT #SUB 200 200 ASP A 102 102 THR B Protein S 3 FT #SUB 200 200 ASP A 103 103 THR B Protein A 4 FT #SUB 204 204 ALA A 103 103 THR B Protein S 1 FT #SUB 204 204 ALA A 104 104 VAL B Protein B 1 FT #SUB 207 207 HIS A 104 104 VAL B Protein S 1 FT #SUB 209 209 HIS A 107 107 LYS B Protein S 5 FT #SUB 210 210 HIS A 107 107 LYS B Protein B 1 FT #SUB 210 210 HIS A 111 111 ASN B Protein B 4 FT #SUB 210 210 HIS A 119 119 PHE B Protein S 19 FT #SUB 212 212 LEU A 18 18 LEU B Protein S 2 FT #SUB 212 212 LEU A 150 150 ILE B Protein A 3 FT #SUB 212 212 LEU A 151 151 THR B Protein S 1 FT #SUB 213 213 SER A 150 150 ILE B Protein B 1 FT #SUB 214 214 VAL A 214 214 VAL B Protein S 1 FT #SUB 214 214 VAL A 220 220 SER B Protein S 2 FT #SUB 217 217 ALA A 219 219 HIS B Protein B 1 FT #SUB 218 218 GLY A 219 219 HIS B Protein B 7 FT #SUB 218 218 GLY A 220 220 SER B Protein B 6 FT #SUB 219 219 HIS A 217 217 ALA B Protein S 1 FT #SUB 219 219 HIS A 218 218 GLY B Protein A 7 FT #SUB 219 219 HIS A 219 219 HIS B Protein S 14 FT #SUB 220 220 SER A 18 18 LEU B Protein A 3 FT #SUB 220 220 SER A 214 214 VAL B Protein S 2 FT #SUB 220 220 SER A 218 218 GLY B Protein A 6 FT #SUB 221 221 ALA A 18 18 LEU B Protein B 3 FT #SUB 17 17 GLU A 22 22 ILE C Protein S 1 FT #SUB 18 18 LEU A 22 22 ILE C Protein B 1 FT #SUB 19 19 LEU A 22 22 ILE C Protein S 3 FT #SUB 19 19 LEU A 23 23 ALA C Protein S 2 FT #SUB 19 19 LEU A 26 26 TYR C Protein S 2 FT #SUB 22 22 ILE A 17 17 GLU C Protein S 2 FT #SUB 22 22 ILE A 18 18 LEU C Protein S 1 FT #SUB 22 22 ILE A 19 19 LEU C Protein A 5 FT #SUB 23 23 ALA A 19 19 LEU C Protein B 2 FT #SUB 23 23 ALA A 23 23 ALA C Protein S 1 FT #SUB 26 26 TYR A 19 19 LEU C Protein S 3 FT #SUB 26 26 TYR A 122 122 ASN C Protein S 2 FT #SUB 26 26 TYR A 123 123 PHE C Protein S 3 FT #SUB 27 27 GLU A 27 27 GLU C Protein S 1 FT #SUB 27 27 GLU A 126 126 ARG C Protein S 4 FT #SUB 122 122 ASN A 26 26 TYR C Protein A 2 FT #SUB 123 123 PHE A 26 26 TYR C Protein A 3 FT #SUB 126 126 ARG A 27 27 GLU C Protein S 4 FT #SUB 219 219 HIS A 219 219 HIS C Protein S 7 FT #SUB 219 219 HIS A 219 219 HIS D Protein S 4 FT #HET 63 63 CYS A 1 1351 MN A S 2 FT #HET 63 63 CYS A 3 1353 0V5 A S 1 FT #HET 94 94 ARG A 3 1353 0V5 A S 5 FT #HET 96 96 TYR A 3 1353 0V5 A S 1 FT #HET 99 99 LYS A 3 1353 0V5 A S 4 FT #HET 100 100 PRO A 3 1353 0V5 A S 2 FT #HET 101 101 ARG A 2 1352 PO4 A A 12 FT #HET 102 102 THR A 2 1352 PO4 A A 9 FT #HET 145 145 GLU A 3 1353 0V5 A S 1 FT #HET 165 165 GLY A 3 1353 0V5 A B 2 FT #HET 166 166 ALA A 3 1353 0V5 A A 3 FT #HET 167 167 ARG A 3 1353 0V5 A S 5 FT #HET 188 188 LYS A 3 1353 0V5 A S 7 FT #HET 236 236 ARG A 3 1353 0V5 A S 8 FT #HET 270 270 HIS A 1 1351 MN A S 3 FT #HET 270 270 HIS A 3 1353 0V5 A S 13 FT #HET 304 304 GLU A 1 1351 MN A S 3 FT #HET 304 304 GLU A 3 1353 0V5 A S 2 FT #HET 324 324 ASP A 1 1351 MN A S 4 FT #HET 324 324 ASP A 3 1353 0V5 A S 1 FT DISORDER 1 15 FT DISORDER 351 351 CC SEQUENCE 335 AA (ATOM); CC KELLPPIAHL YELPISKEAS GLVHRTRQEI SDLVHGRDKR LLVIIGPCSI HDPKAALEYA CC ERLLKLRKQY ENELLIVMRV YFEKPRTTVG WKGLINDPHL DGTFDINFGL RQARSLLLSL CC NNMGMPASTE FLDMITPQYY ADLISWGAIG ARTTESQVHR ELASGLSCPV GFKNGTDGNL CC KIAIDAIGAA SHSHHFLSVT KAGHSAIVHT GGNPDCHVIL RGGKEPNYDA EHVSEAAEQL CC RAAGVTDKLM IDCSHANSRK DYTRQMEVAQ DIAAQLEQDG GNIMGVMVES HLVEGRQDKP CC EVYGKSITDA CIGWGATEEL LALLAGANKK RMARA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MTHHYPTDDIKIKEVKELLPPIAHLYELPISKEASGLVHRTRQEISDLVH CC ATOM ---------------KELLPPIAHLYELPISKEASGLVHRTRQEISDLVH CC *********************************** CC SEQRES GRDKRLLVIIGPCSIHDPKAALEYAERLLKLRKQYENELLIVMRVYFEKP CC ATOM GRDKRLLVIIGPCSIHDPKAALEYAERLLKLRKQYENELLIVMRVYFEKP CC ************************************************** CC SEQRES RTTVGWKGLINDPHLDGTFDINFGLRQARSLLLSLNNMGMPASTEFLDMI CC ATOM RTTVGWKGLINDPHLDGTFDINFGLRQARSLLLSLNNMGMPASTEFLDMI CC ************************************************** CC SEQRES TPQYYADLISWGAIGARTTESQVHRELASGLSCPVGFKNGTDGNLKIAID CC ATOM TPQYYADLISWGAIGARTTESQVHRELASGLSCPVGFKNGTDGNLKIAID CC ************************************************** CC SEQRES AIGAASHSHHFLSVTKAGHSAIVHTGGNPDCHVILRGGKEPNYDAEHVSE CC ATOM AIGAASHSHHFLSVTKAGHSAIVHTGGNPDCHVILRGGKEPNYDAEHVSE CC ************************************************** CC SEQRES AAEQLRAAGVTDKLMIDCSHANSRKDYTRQMEVAQDIAAQLEQDGGNIMG CC ATOM AAEQLRAAGVTDKLMIDCSHANSRKDYTRQMEVAQDIAAQLEQDGGNIMG CC ************************************************** CC SEQRES VMVESHLVEGRQDKPEVYGKSITDACIGWGATEELLALLAGANKKRMARA CC ATOM VMVESHLVEGRQDKPEVYGKSITDACIGWGATEELLALLAGANKKRMARA CC ************************************************** CC SEQRES S CC ATOM - CC SQ SEQUENCE 351 AA; MW; CN; MTHHYPTDDI KIKEVKELLP PIAHLYELPI SKEASGLVHR TRQEISDLVH GRDKRLLVII GPCSIHDPKA ALEYAERLLK LRKQYENELL IVMRVYFEKP RTTVGWKGLI NDPHLDGTFD INFGLRQARS LLLSLNNMGM PASTEFLDMI TPQYYADLIS WGAIGARTTE SQVHRELASG LSCPVGFKNG TDGNLKIAID AIGAASHSHH FLSVTKAGHS AIVHTGGNPD CHVILRGGKE PNYDAEHVSE AAEQLRAAGV TDKLMIDCSH ANSRKDYTRQ MEVAQDIAAQ LEQDGGNIMG VMVESHLVEG RQDKPEVYGK SITDACIGWG ATEELLALLA GANKKRMARA S // ID 4UMBB STANDARD; PRT; 351 AA. DT CONVERTED FROM PDB (SEQRES) 4UMB DE PHOSPHO-2-DEHYDRO-3-DEOXYHEPTONATE ALDOLASE OS NEISSERIA MENINGITIDIS CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.170 CC R-Factor 0.202 FT #SUB 18 18 LEU B 212 212 LEU A Protein S 2 FT #SUB 18 18 LEU B 220 220 SER A Protein S 3 FT #SUB 18 18 LEU B 221 221 ALA A Protein S 3 FT #SUB 99 99 LYS B 172 172 GLN A Protein B 4 FT #SUB 100 100 PRO B 172 172 GLN A Protein B 4 FT #SUB 101 101 ARG B 172 172 GLN A Protein A 6 FT #SUB 101 101 ARG B 175 175 ARG A Protein B 1 FT #SUB 102 102 THR B 175 175 ARG A Protein B 4 FT #SUB 102 102 THR B 200 200 ASP A Protein A 3 FT #SUB 103 103 THR B 200 200 ASP A Protein S 4 FT #SUB 103 103 THR B 204 204 ALA A Protein B 1 FT #SUB 104 104 VAL B 204 204 ALA A Protein S 1 FT #SUB 104 104 VAL B 207 207 HIS A Protein S 1 FT #SUB 107 107 LYS B 172 172 GLN A Protein S 4 FT #SUB 107 107 LYS B 176 176 GLU A Protein S 5 FT #SUB 107 107 LYS B 209 209 HIS A Protein S 5 FT #SUB 107 107 LYS B 210 210 HIS A Protein S 1 FT #SUB 111 111 ASN B 210 210 HIS A Protein S 4 FT #SUB 119 119 PHE B 210 210 HIS A Protein S 19 FT #SUB 147 147 LEU B 172 172 GLN A Protein S 1 FT #SUB 147 147 LEU B 173 173 VAL A Protein B 1 FT #SUB 149 149 MET B 149 149 MET A Protein S 1 FT #SUB 150 150 ILE B 212 212 LEU A Protein S 3 FT #SUB 150 150 ILE B 213 213 SER A Protein S 1 FT #SUB 151 151 THR B 212 212 LEU A Protein S 1 FT #SUB 167 167 ARG B 170 170 GLU A Protein A 7 FT #SUB 167 167 ARG B 171 171 SER A Protein B 2 FT #SUB 168 168 THR B 171 171 SER A Protein S 3 FT #SUB 170 170 GLU B 167 167 ARG A Protein A 8 FT #SUB 170 170 GLU B 191 191 THR A Protein S 5 FT #SUB 171 171 SER B 167 167 ARG A Protein B 2 FT #SUB 171 171 SER B 168 168 THR A Protein A 3 FT #SUB 171 171 SER B 174 174 HIS A Protein S 1 FT #SUB 172 172 GLN B 99 99 LYS A Protein S 4 FT #SUB 172 172 GLN B 100 100 PRO A Protein S 4 FT #SUB 172 172 GLN B 101 101 ARG A Protein S 6 FT #SUB 172 172 GLN B 107 107 LYS A Protein S 4 FT #SUB 172 172 GLN B 147 147 LEU A Protein S 1 FT #SUB 173 173 VAL B 147 147 LEU A Protein S 1 FT #SUB 173 173 VAL B 174 174 HIS A Protein S 1 FT #SUB 174 174 HIS B 171 171 SER A Protein S 1 FT #SUB 174 174 HIS B 173 173 VAL A Protein S 1 FT #SUB 175 175 ARG B 101 101 ARG A Protein S 1 FT #SUB 175 175 ARG B 102 102 THR A Protein S 4 FT #SUB 176 176 GLU B 107 107 LYS A Protein S 5 FT #SUB 191 191 THR B 170 170 GLU A Protein S 5 FT #SUB 192 192 ASP B 194 194 ASN A Protein S 5 FT #SUB 194 194 ASN B 192 192 ASP A Protein S 5 FT #SUB 200 200 ASP B 102 102 THR A Protein S 3 FT #SUB 200 200 ASP B 103 103 THR A Protein A 4 FT #SUB 204 204 ALA B 103 103 THR A Protein S 1 FT #SUB 207 207 HIS B 104 104 VAL A Protein S 1 FT #SUB 209 209 HIS B 107 107 LYS A Protein S 5 FT #SUB 210 210 HIS B 107 107 LYS A Protein B 1 FT #SUB 210 210 HIS B 111 111 ASN A Protein B 4 FT #SUB 210 210 HIS B 119 119 PHE A Protein S 20 FT #SUB 212 212 LEU B 18 18 LEU A Protein S 2 FT #SUB 212 212 LEU B 150 150 ILE A Protein B 2 FT #SUB 212 212 LEU B 151 151 THR A Protein S 1 FT #SUB 214 214 VAL B 214 214 VAL A Protein S 1 FT #SUB 214 214 VAL B 220 220 SER A Protein S 2 FT #SUB 217 217 ALA B 219 219 HIS A Protein B 1 FT #SUB 218 218 GLY B 219 219 HIS A Protein B 7 FT #SUB 218 218 GLY B 220 220 SER A Protein B 6 FT #SUB 219 219 HIS B 217 217 ALA A Protein S 1 FT #SUB 219 219 HIS B 218 218 GLY A Protein A 7 FT #SUB 219 219 HIS B 219 219 HIS A Protein S 14 FT #SUB 220 220 SER B 18 18 LEU A Protein A 3 FT #SUB 220 220 SER B 214 214 VAL A Protein S 2 FT #SUB 220 220 SER B 218 218 GLY A Protein A 6 FT #SUB 221 221 ALA B 18 18 LEU A Protein B 3 FT #SUB 222 222 ILE B 16 16 LYS A Protein A 4 FT #SUB 219 219 HIS B 219 219 HIS C Protein S 4 FT #SUB 17 17 GLU B 22 22 ILE D Protein S 2 FT #SUB 18 18 LEU B 22 22 ILE D Protein B 1 FT #SUB 19 19 LEU B 22 22 ILE D Protein S 5 FT #SUB 19 19 LEU B 23 23 ALA D Protein S 2 FT #SUB 19 19 LEU B 26 26 TYR D Protein S 4 FT #SUB 22 22 ILE B 17 17 GLU D Protein S 2 FT #SUB 22 22 ILE B 18 18 LEU D Protein S 1 FT #SUB 22 22 ILE B 19 19 LEU D Protein A 3 FT #SUB 23 23 ALA B 19 19 LEU D Protein B 2 FT #SUB 23 23 ALA B 23 23 ALA D Protein S 1 FT #SUB 26 26 TYR B 19 19 LEU D Protein S 3 FT #SUB 26 26 TYR B 122 122 ASN D Protein S 4 FT #SUB 26 26 TYR B 123 123 PHE D Protein S 2 FT #SUB 27 27 GLU B 27 27 GLU D Protein S 5 FT #SUB 27 27 GLU B 126 126 ARG D Protein S 4 FT #SUB 122 122 ASN B 26 26 TYR D Protein A 3 FT #SUB 123 123 PHE B 26 26 TYR D Protein A 3 FT #SUB 126 126 ARG B 26 26 TYR D Protein S 1 FT #SUB 126 126 ARG B 27 27 GLU D Protein S 4 FT #SUB 219 219 HIS B 219 219 HIS D Protein S 8 FT #HET 63 63 CYS B 4 1350 MN B S 2 FT #HET 63 63 CYS B 5 1351 0V5 B S 1 FT #HET 94 94 ARG B 5 1351 0V5 B S 5 FT #HET 96 96 TYR B 5 1351 0V5 B S 1 FT #HET 99 99 LYS B 5 1351 0V5 B S 3 FT #HET 100 100 PRO B 5 1351 0V5 B S 2 FT #HET 101 101 ARG B 6 1352 PO4 B A 12 FT #HET 102 102 THR B 6 1352 PO4 B A 8 FT #HET 145 145 GLU B 5 1351 0V5 B S 1 FT #HET 165 165 GLY B 5 1351 0V5 B B 2 FT #HET 166 166 ALA B 5 1351 0V5 B A 3 FT #HET 167 167 ARG B 5 1351 0V5 B S 5 FT #HET 188 188 LYS B 5 1351 0V5 B S 8 FT #HET 236 236 ARG B 5 1351 0V5 B S 8 FT #HET 270 270 HIS B 4 1350 MN B S 3 FT #HET 270 270 HIS B 5 1351 0V5 B S 12 FT #HET 304 304 GLU B 4 1350 MN B S 3 FT #HET 304 304 GLU B 5 1351 0V5 B S 2 FT #HET 324 324 ASP B 4 1350 MN B S 4 FT #HET 324 324 ASP B 5 1351 0V5 B S 1 FT DISORDER 1 16 FT DISORDER 350 351 CC SEQUENCE 333 AA (ATOM); CC ELLPPIAHLY ELPISKEASG LVHRTRQEIS DLVHGRDKRL LVIIGPCSIH DPKAALEYAE CC RLLKLRKQYE NELLIVMRVY FEKPRTTVGW KGLINDPHLD GTFDINFGLR QARSLLLSLN CC NMGMPASTEF LDMITPQYYA DLISWGAIGA RTTESQVHRE LASGLSCPVG FKNGTDGNLK CC IAIDAIGAAS HSHHFLSVTK AGHSAIVHTG GNPDCHVILR GGKEPNYDAE HVSEAAEQLR CC AAGVTDKLMI DCSHANSRKD YTRQMEVAQD IAAQLEQDGG NIMGVMVESH LVEGRQDKPE CC VYGKSITDAC IGWGATEELL ALLAGANKKR MAR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MTHHYPTDDIKIKEVKELLPPIAHLYELPISKEASGLVHRTRQEISDLVH CC ATOM ----------------ELLPPIAHLYELPISKEASGLVHRTRQEISDLVH CC ********************************** CC SEQRES GRDKRLLVIIGPCSIHDPKAALEYAERLLKLRKQYENELLIVMRVYFEKP CC ATOM GRDKRLLVIIGPCSIHDPKAALEYAERLLKLRKQYENELLIVMRVYFEKP CC ************************************************** CC SEQRES RTTVGWKGLINDPHLDGTFDINFGLRQARSLLLSLNNMGMPASTEFLDMI CC ATOM RTTVGWKGLINDPHLDGTFDINFGLRQARSLLLSLNNMGMPASTEFLDMI CC ************************************************** CC SEQRES TPQYYADLISWGAIGARTTESQVHRELASGLSCPVGFKNGTDGNLKIAID CC ATOM TPQYYADLISWGAIGARTTESQVHRELASGLSCPVGFKNGTDGNLKIAID CC ************************************************** CC SEQRES AIGAASHSHHFLSVTKAGHSAIVHTGGNPDCHVILRGGKEPNYDAEHVSE CC ATOM AIGAASHSHHFLSVTKAGHSAIVHTGGNPDCHVILRGGKEPNYDAEHVSE CC ************************************************** CC SEQRES AAEQLRAAGVTDKLMIDCSHANSRKDYTRQMEVAQDIAAQLEQDGGNIMG CC ATOM AAEQLRAAGVTDKLMIDCSHANSRKDYTRQMEVAQDIAAQLEQDGGNIMG CC ************************************************** CC SEQRES VMVESHLVEGRQDKPEVYGKSITDACIGWGATEELLALLAGANKKRMARA CC ATOM VMVESHLVEGRQDKPEVYGKSITDACIGWGATEELLALLAGANKKRMAR- CC ************************************************* CC SEQRES S CC ATOM - CC SQ SEQUENCE 351 AA; MW; CN; MTHHYPTDDI KIKEVKELLP PIAHLYELPI SKEASGLVHR TRQEISDLVH GRDKRLLVII GPCSIHDPKA ALEYAERLLK LRKQYENELL IVMRVYFEKP RTTVGWKGLI NDPHLDGTFD INFGLRQARS LLLSLNNMGM PASTEFLDMI TPQYYADLIS WGAIGARTTE SQVHRELASG LSCPVGFKNG TDGNLKIAID AIGAASHSHH FLSVTKAGHS AIVHTGGNPD CHVILRGGKE PNYDAEHVSE AAEQLRAAGV TDKLMIDCSH ANSRKDYTRQ MEVAQDIAAQ LEQDGGNIMG VMVESHLVEG RQDKPEVYGK SITDACIGWG ATEELLALLA GANKKRMARA S // ID 4UMBC STANDARD; PRT; 351 AA. DT CONVERTED FROM PDB (SEQRES) 4UMB DE PHOSPHO-2-DEHYDRO-3-DEOXYHEPTONATE ALDOLASE OS NEISSERIA MENINGITIDIS CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.170 CC R-Factor 0.202 FT #SUB 17 17 GLU C 22 22 ILE A Protein S 2 FT #SUB 18 18 LEU C 22 22 ILE A Protein B 1 FT #SUB 19 19 LEU C 22 22 ILE A Protein S 5 FT #SUB 19 19 LEU C 23 23 ALA A Protein S 2 FT #SUB 19 19 LEU C 26 26 TYR A Protein S 3 FT #SUB 22 22 ILE C 17 17 GLU A Protein S 1 FT #SUB 22 22 ILE C 18 18 LEU A Protein S 1 FT #SUB 22 22 ILE C 19 19 LEU A Protein A 3 FT #SUB 23 23 ALA C 19 19 LEU A Protein B 2 FT #SUB 23 23 ALA C 23 23 ALA A Protein S 1 FT #SUB 26 26 TYR C 19 19 LEU A Protein S 2 FT #SUB 26 26 TYR C 122 122 ASN A Protein S 2 FT #SUB 26 26 TYR C 123 123 PHE A Protein S 3 FT #SUB 27 27 GLU C 27 27 GLU A Protein S 1 FT #SUB 27 27 GLU C 126 126 ARG A Protein S 4 FT #SUB 122 122 ASN C 26 26 TYR A Protein A 2 FT #SUB 123 123 PHE C 26 26 TYR A Protein A 3 FT #SUB 126 126 ARG C 27 27 GLU A Protein S 4 FT #SUB 219 219 HIS C 219 219 HIS A Protein S 7 FT #SUB 219 219 HIS C 219 219 HIS B Protein S 4 FT #SUB 18 18 LEU C 212 212 LEU D Protein S 2 FT #SUB 18 18 LEU C 220 220 SER D Protein S 3 FT #SUB 18 18 LEU C 221 221 ALA D Protein S 3 FT #SUB 99 99 LYS C 172 172 GLN D Protein B 4 FT #SUB 100 100 PRO C 172 172 GLN D Protein B 4 FT #SUB 101 101 ARG C 172 172 GLN D Protein A 6 FT #SUB 101 101 ARG C 175 175 ARG D Protein B 1 FT #SUB 102 102 THR C 175 175 ARG D Protein B 4 FT #SUB 102 102 THR C 200 200 ASP D Protein A 3 FT #SUB 103 103 THR C 200 200 ASP D Protein S 4 FT #SUB 103 103 THR C 204 204 ALA D Protein B 1 FT #SUB 104 104 VAL C 204 204 ALA D Protein S 1 FT #SUB 104 104 VAL C 207 207 HIS D Protein S 1 FT #SUB 107 107 LYS C 172 172 GLN D Protein S 4 FT #SUB 107 107 LYS C 176 176 GLU D Protein S 5 FT #SUB 107 107 LYS C 209 209 HIS D Protein S 5 FT #SUB 107 107 LYS C 210 210 HIS D Protein S 1 FT #SUB 111 111 ASN C 210 210 HIS D Protein S 4 FT #SUB 119 119 PHE C 210 210 HIS D Protein S 20 FT #SUB 147 147 LEU C 172 172 GLN D Protein S 1 FT #SUB 147 147 LEU C 173 173 VAL D Protein B 1 FT #SUB 149 149 MET C 149 149 MET D Protein S 1 FT #SUB 150 150 ILE C 212 212 LEU D Protein S 3 FT #SUB 151 151 THR C 212 212 LEU D Protein S 1 FT #SUB 167 167 ARG C 170 170 GLU D Protein A 9 FT #SUB 167 167 ARG C 171 171 SER D Protein B 2 FT #SUB 168 168 THR C 171 171 SER D Protein S 3 FT #SUB 170 170 GLU C 167 167 ARG D Protein A 9 FT #SUB 170 170 GLU C 191 191 THR D Protein S 5 FT #SUB 171 171 SER C 167 167 ARG D Protein B 2 FT #SUB 171 171 SER C 168 168 THR D Protein A 3 FT #SUB 171 171 SER C 174 174 HIS D Protein S 1 FT #SUB 172 172 GLN C 99 99 LYS D Protein S 4 FT #SUB 172 172 GLN C 100 100 PRO D Protein S 4 FT #SUB 172 172 GLN C 101 101 ARG D Protein S 5 FT #SUB 172 172 GLN C 107 107 LYS D Protein S 4 FT #SUB 172 172 GLN C 147 147 LEU D Protein S 1 FT #SUB 173 173 VAL C 147 147 LEU D Protein S 1 FT #SUB 173 173 VAL C 174 174 HIS D Protein S 1 FT #SUB 174 174 HIS C 171 171 SER D Protein S 1 FT #SUB 174 174 HIS C 173 173 VAL D Protein S 1 FT #SUB 175 175 ARG C 101 101 ARG D Protein S 1 FT #SUB 175 175 ARG C 102 102 THR D Protein S 4 FT #SUB 176 176 GLU C 107 107 LYS D Protein S 5 FT #SUB 191 191 THR C 170 170 GLU D Protein S 5 FT #SUB 192 192 ASP C 194 194 ASN D Protein S 5 FT #SUB 194 194 ASN C 192 192 ASP D Protein S 5 FT #SUB 200 200 ASP C 102 102 THR D Protein S 4 FT #SUB 200 200 ASP C 103 103 THR D Protein A 4 FT #SUB 204 204 ALA C 103 103 THR D Protein S 1 FT #SUB 204 204 ALA C 104 104 VAL D Protein B 1 FT #SUB 207 207 HIS C 104 104 VAL D Protein S 1 FT #SUB 209 209 HIS C 107 107 LYS D Protein S 4 FT #SUB 210 210 HIS C 107 107 LYS D Protein B 1 FT #SUB 210 210 HIS C 111 111 ASN D Protein B 4 FT #SUB 210 210 HIS C 119 119 PHE D Protein S 19 FT #SUB 212 212 LEU C 18 18 LEU D Protein S 2 FT #SUB 212 212 LEU C 150 150 ILE D Protein A 2 FT #SUB 212 212 LEU C 151 151 THR D Protein S 1 FT #SUB 214 214 VAL C 214 214 VAL D Protein S 1 FT #SUB 214 214 VAL C 220 220 SER D Protein S 2 FT #SUB 217 217 ALA C 219 219 HIS D Protein B 2 FT #SUB 218 218 GLY C 219 219 HIS D Protein B 9 FT #SUB 218 218 GLY C 220 220 SER D Protein B 6 FT #SUB 219 219 HIS C 217 217 ALA D Protein S 1 FT #SUB 219 219 HIS C 218 218 GLY D Protein A 7 FT #SUB 219 219 HIS C 219 219 HIS D Protein S 10 FT #SUB 220 220 SER C 18 18 LEU D Protein A 3 FT #SUB 220 220 SER C 214 214 VAL D Protein S 1 FT #SUB 220 220 SER C 218 218 GLY D Protein A 6 FT #SUB 221 221 ALA C 18 18 LEU D Protein B 3 FT #HET 63 63 CYS C 7 1350 MN C S 2 FT #HET 63 63 CYS C 8 1351 0V5 C S 1 FT #HET 94 94 ARG C 8 1351 0V5 C S 5 FT #HET 96 96 TYR C 8 1351 0V5 C S 1 FT #HET 99 99 LYS C 8 1351 0V5 C S 3 FT #HET 100 100 PRO C 8 1351 0V5 C S 2 FT #HET 101 101 ARG C 9 1352 PO4 C A 11 FT #HET 102 102 THR C 9 1352 PO4 C A 9 FT #HET 145 145 GLU C 8 1351 0V5 C S 1 FT #HET 165 165 GLY C 8 1351 0V5 C B 2 FT #HET 166 166 ALA C 8 1351 0V5 C A 4 FT #HET 167 167 ARG C 8 1351 0V5 C S 5 FT #HET 188 188 LYS C 8 1351 0V5 C S 8 FT #HET 236 236 ARG C 8 1351 0V5 C S 8 FT #HET 270 270 HIS C 7 1350 MN C S 3 FT #HET 270 270 HIS C 8 1351 0V5 C S 12 FT #HET 304 304 GLU C 7 1350 MN C S 3 FT #HET 304 304 GLU C 8 1351 0V5 C S 2 FT #HET 324 324 ASP C 7 1350 MN C S 4 FT #HET 324 324 ASP C 8 1351 0V5 C S 1 FT DISORDER 1 16 FT DISORDER 350 351 CC SEQUENCE 333 AA (ATOM); CC ELLPPIAHLY ELPISKEASG LVHRTRQEIS DLVHGRDKRL LVIIGPCSIH DPKAALEYAE CC RLLKLRKQYE NELLIVMRVY FEKPRTTVGW KGLINDPHLD GTFDINFGLR QARSLLLSLN CC NMGMPASTEF LDMITPQYYA DLISWGAIGA RTTESQVHRE LASGLSCPVG FKNGTDGNLK CC IAIDAIGAAS HSHHFLSVTK AGHSAIVHTG GNPDCHVILR GGKEPNYDAE HVSEAAEQLR CC AAGVTDKLMI DCSHANSRKD YTRQMEVAQD IAAQLEQDGG NIMGVMVESH LVEGRQDKPE CC VYGKSITDAC IGWGATEELL ALLAGANKKR MAR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MTHHYPTDDIKIKEVKELLPPIAHLYELPISKEASGLVHRTRQEISDLVH CC ATOM ----------------ELLPPIAHLYELPISKEASGLVHRTRQEISDLVH CC ********************************** CC SEQRES GRDKRLLVIIGPCSIHDPKAALEYAERLLKLRKQYENELLIVMRVYFEKP CC ATOM GRDKRLLVIIGPCSIHDPKAALEYAERLLKLRKQYENELLIVMRVYFEKP CC ************************************************** CC SEQRES RTTVGWKGLINDPHLDGTFDINFGLRQARSLLLSLNNMGMPASTEFLDMI CC ATOM RTTVGWKGLINDPHLDGTFDINFGLRQARSLLLSLNNMGMPASTEFLDMI CC ************************************************** CC SEQRES TPQYYADLISWGAIGARTTESQVHRELASGLSCPVGFKNGTDGNLKIAID CC ATOM TPQYYADLISWGAIGARTTESQVHRELASGLSCPVGFKNGTDGNLKIAID CC ************************************************** CC SEQRES AIGAASHSHHFLSVTKAGHSAIVHTGGNPDCHVILRGGKEPNYDAEHVSE CC ATOM AIGAASHSHHFLSVTKAGHSAIVHTGGNPDCHVILRGGKEPNYDAEHVSE CC ************************************************** CC SEQRES AAEQLRAAGVTDKLMIDCSHANSRKDYTRQMEVAQDIAAQLEQDGGNIMG CC ATOM AAEQLRAAGVTDKLMIDCSHANSRKDYTRQMEVAQDIAAQLEQDGGNIMG CC ************************************************** CC SEQRES VMVESHLVEGRQDKPEVYGKSITDACIGWGATEELLALLAGANKKRMARA CC ATOM VMVESHLVEGRQDKPEVYGKSITDACIGWGATEELLALLAGANKKRMAR- CC ************************************************* CC SEQRES S CC ATOM - CC SQ SEQUENCE 351 AA; MW; CN; MTHHYPTDDI KIKEVKELLP PIAHLYELPI SKEASGLVHR TRQEISDLVH GRDKRLLVII GPCSIHDPKA ALEYAERLLK LRKQYENELL IVMRVYFEKP RTTVGWKGLI NDPHLDGTFD INFGLRQARS LLLSLNNMGM PASTEFLDMI TPQYYADLIS WGAIGARTTE SQVHRELASG LSCPVGFKNG TDGNLKIAID AIGAASHSHH FLSVTKAGHS AIVHTGGNPD CHVILRGGKE PNYDAEHVSE AAEQLRAAGV TDKLMIDCSH ANSRKDYTRQ MEVAQDIAAQ LEQDGGNIMG VMVESHLVEG RQDKPEVYGK SITDACIGWG ATEELLALLA GANKKRMARA S // ID 4UMBD STANDARD; PRT; 351 AA. DT CONVERTED FROM PDB (SEQRES) 4UMB DE PHOSPHO-2-DEHYDRO-3-DEOXYHEPTONATE ALDOLASE OS NEISSERIA MENINGITIDIS CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.170 CC R-Factor 0.202 FT #SUB 219 219 HIS D 219 219 HIS A Protein S 4 FT #SUB 17 17 GLU D 22 22 ILE B Protein S 2 FT #SUB 18 18 LEU D 22 22 ILE B Protein B 1 FT #SUB 19 19 LEU D 22 22 ILE B Protein S 3 FT #SUB 19 19 LEU D 23 23 ALA B Protein S 2 FT #SUB 19 19 LEU D 26 26 TYR B Protein S 3 FT #SUB 22 22 ILE D 17 17 GLU B Protein S 2 FT #SUB 22 22 ILE D 18 18 LEU B Protein S 1 FT #SUB 22 22 ILE D 19 19 LEU B Protein A 5 FT #SUB 23 23 ALA D 19 19 LEU B Protein B 2 FT #SUB 23 23 ALA D 23 23 ALA B Protein S 1 FT #SUB 26 26 TYR D 19 19 LEU B Protein S 4 FT #SUB 26 26 TYR D 122 122 ASN B Protein S 3 FT #SUB 26 26 TYR D 123 123 PHE B Protein S 3 FT #SUB 26 26 TYR D 126 126 ARG B Protein S 1 FT #SUB 27 27 GLU D 27 27 GLU B Protein S 5 FT #SUB 27 27 GLU D 126 126 ARG B Protein S 4 FT #SUB 122 122 ASN D 26 26 TYR B Protein A 4 FT #SUB 123 123 PHE D 26 26 TYR B Protein B 2 FT #SUB 126 126 ARG D 27 27 GLU B Protein S 4 FT #SUB 219 219 HIS D 219 219 HIS B Protein S 8 FT #SUB 18 18 LEU D 212 212 LEU C Protein S 2 FT #SUB 18 18 LEU D 220 220 SER C Protein S 3 FT #SUB 18 18 LEU D 221 221 ALA C Protein S 3 FT #SUB 99 99 LYS D 172 172 GLN C Protein B 4 FT #SUB 100 100 PRO D 172 172 GLN C Protein B 4 FT #SUB 101 101 ARG D 172 172 GLN C Protein A 5 FT #SUB 101 101 ARG D 175 175 ARG C Protein B 1 FT #SUB 102 102 THR D 175 175 ARG C Protein B 4 FT #SUB 102 102 THR D 200 200 ASP C Protein A 4 FT #SUB 103 103 THR D 200 200 ASP C Protein S 4 FT #SUB 103 103 THR D 204 204 ALA C Protein B 1 FT #SUB 104 104 VAL D 204 204 ALA C Protein S 1 FT #SUB 104 104 VAL D 207 207 HIS C Protein S 1 FT #SUB 107 107 LYS D 172 172 GLN C Protein S 4 FT #SUB 107 107 LYS D 176 176 GLU C Protein S 5 FT #SUB 107 107 LYS D 209 209 HIS C Protein S 4 FT #SUB 107 107 LYS D 210 210 HIS C Protein S 1 FT #SUB 111 111 ASN D 210 210 HIS C Protein S 4 FT #SUB 119 119 PHE D 210 210 HIS C Protein S 19 FT #SUB 147 147 LEU D 172 172 GLN C Protein S 1 FT #SUB 147 147 LEU D 173 173 VAL C Protein B 1 FT #SUB 149 149 MET D 149 149 MET C Protein S 1 FT #SUB 150 150 ILE D 212 212 LEU C Protein S 2 FT #SUB 151 151 THR D 212 212 LEU C Protein S 1 FT #SUB 167 167 ARG D 170 170 GLU C Protein A 9 FT #SUB 167 167 ARG D 171 171 SER C Protein B 2 FT #SUB 168 168 THR D 171 171 SER C Protein S 3 FT #SUB 170 170 GLU D 167 167 ARG C Protein A 9 FT #SUB 170 170 GLU D 191 191 THR C Protein S 5 FT #SUB 171 171 SER D 167 167 ARG C Protein B 2 FT #SUB 171 171 SER D 168 168 THR C Protein A 3 FT #SUB 171 171 SER D 174 174 HIS C Protein S 1 FT #SUB 172 172 GLN D 99 99 LYS C Protein S 4 FT #SUB 172 172 GLN D 100 100 PRO C Protein S 4 FT #SUB 172 172 GLN D 101 101 ARG C Protein S 6 FT #SUB 172 172 GLN D 107 107 LYS C Protein S 4 FT #SUB 172 172 GLN D 147 147 LEU C Protein S 1 FT #SUB 173 173 VAL D 147 147 LEU C Protein S 1 FT #SUB 173 173 VAL D 174 174 HIS C Protein S 1 FT #SUB 174 174 HIS D 171 171 SER C Protein S 1 FT #SUB 174 174 HIS D 173 173 VAL C Protein S 1 FT #SUB 175 175 ARG D 101 101 ARG C Protein S 1 FT #SUB 175 175 ARG D 102 102 THR C Protein S 4 FT #SUB 176 176 GLU D 107 107 LYS C Protein S 5 FT #SUB 191 191 THR D 170 170 GLU C Protein S 5 FT #SUB 192 192 ASP D 194 194 ASN C Protein S 5 FT #SUB 194 194 ASN D 192 192 ASP C Protein S 5 FT #SUB 200 200 ASP D 102 102 THR C Protein S 3 FT #SUB 200 200 ASP D 103 103 THR C Protein A 4 FT #SUB 204 204 ALA D 103 103 THR C Protein S 1 FT #SUB 204 204 ALA D 104 104 VAL C Protein B 1 FT #SUB 207 207 HIS D 104 104 VAL C Protein S 1 FT #SUB 209 209 HIS D 107 107 LYS C Protein S 5 FT #SUB 210 210 HIS D 107 107 LYS C Protein B 1 FT #SUB 210 210 HIS D 111 111 ASN C Protein B 4 FT #SUB 210 210 HIS D 119 119 PHE C Protein S 20 FT #SUB 212 212 LEU D 18 18 LEU C Protein S 2 FT #SUB 212 212 LEU D 150 150 ILE C Protein A 3 FT #SUB 212 212 LEU D 151 151 THR C Protein S 1 FT #SUB 214 214 VAL D 214 214 VAL C Protein S 1 FT #SUB 214 214 VAL D 220 220 SER C Protein S 1 FT #SUB 217 217 ALA D 219 219 HIS C Protein B 1 FT #SUB 218 218 GLY D 219 219 HIS C Protein B 7 FT #SUB 218 218 GLY D 220 220 SER C Protein B 6 FT #SUB 219 219 HIS D 217 217 ALA C Protein S 2 FT #SUB 219 219 HIS D 218 218 GLY C Protein A 9 FT #SUB 219 219 HIS D 219 219 HIS C Protein S 10 FT #SUB 220 220 SER D 18 18 LEU C Protein A 3 FT #SUB 220 220 SER D 214 214 VAL C Protein S 2 FT #SUB 220 220 SER D 218 218 GLY C Protein A 6 FT #SUB 221 221 ALA D 18 18 LEU C Protein B 3 FT #HET 63 63 CYS D 10 1350 MN D S 2 FT #HET 63 63 CYS D 11 1351 0V5 D S 1 FT #HET 94 94 ARG D 10 1350 MN D S 1 FT #HET 94 94 ARG D 11 1351 0V5 D S 5 FT #HET 96 96 TYR D 11 1351 0V5 D S 1 FT #HET 99 99 LYS D 11 1351 0V5 D S 3 FT #HET 100 100 PRO D 11 1351 0V5 D S 2 FT #HET 101 101 ARG D 12 1352 PO4 D A 13 FT #HET 102 102 THR D 12 1352 PO4 D A 9 FT #HET 145 145 GLU D 11 1351 0V5 D S 1 FT #HET 165 165 GLY D 11 1351 0V5 D B 2 FT #HET 166 166 ALA D 11 1351 0V5 D A 4 FT #HET 167 167 ARG D 11 1351 0V5 D S 5 FT #HET 188 188 LYS D 11 1351 0V5 D S 8 FT #HET 236 236 ARG D 11 1351 0V5 D S 7 FT #HET 270 270 HIS D 10 1350 MN D S 3 FT #HET 270 270 HIS D 11 1351 0V5 D S 13 FT #HET 304 304 GLU D 10 1350 MN D S 3 FT #HET 304 304 GLU D 11 1351 0V5 D S 2 FT #HET 324 324 ASP D 10 1350 MN D S 4 FT #HET 324 324 ASP D 11 1351 0V5 D S 1 FT DISORDER 1 16 FT DISORDER 350 351 CC SEQUENCE 333 AA (ATOM); CC ELLPPIAHLY ELPISKEASG LVHRTRQEIS DLVHGRDKRL LVIIGPCSIH DPKAALEYAE CC RLLKLRKQYE NELLIVMRVY FEKPRTTVGW KGLINDPHLD GTFDINFGLR QARSLLLSLN CC NMGMPASTEF LDMITPQYYA DLISWGAIGA RTTESQVHRE LASGLSCPVG FKNGTDGNLK CC IAIDAIGAAS HSHHFLSVTK AGHSAIVHTG GNPDCHVILR GGKEPNYDAE HVSEAAEQLR CC AAGVTDKLMI DCSHANSRKD YTRQMEVAQD IAAQLEQDGG NIMGVMVESH LVEGRQDKPE CC VYGKSITDAC IGWGATEELL ALLAGANKKR MAR CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MTHHYPTDDIKIKEVKELLPPIAHLYELPISKEASGLVHRTRQEISDLVH CC ATOM ----------------ELLPPIAHLYELPISKEASGLVHRTRQEISDLVH CC ********************************** CC SEQRES GRDKRLLVIIGPCSIHDPKAALEYAERLLKLRKQYENELLIVMRVYFEKP CC ATOM GRDKRLLVIIGPCSIHDPKAALEYAERLLKLRKQYENELLIVMRVYFEKP CC ************************************************** CC SEQRES RTTVGWKGLINDPHLDGTFDINFGLRQARSLLLSLNNMGMPASTEFLDMI CC ATOM RTTVGWKGLINDPHLDGTFDINFGLRQARSLLLSLNNMGMPASTEFLDMI CC ************************************************** CC SEQRES TPQYYADLISWGAIGARTTESQVHRELASGLSCPVGFKNGTDGNLKIAID CC ATOM TPQYYADLISWGAIGARTTESQVHRELASGLSCPVGFKNGTDGNLKIAID CC ************************************************** CC SEQRES AIGAASHSHHFLSVTKAGHSAIVHTGGNPDCHVILRGGKEPNYDAEHVSE CC ATOM AIGAASHSHHFLSVTKAGHSAIVHTGGNPDCHVILRGGKEPNYDAEHVSE CC ************************************************** CC SEQRES AAEQLRAAGVTDKLMIDCSHANSRKDYTRQMEVAQDIAAQLEQDGGNIMG CC ATOM AAEQLRAAGVTDKLMIDCSHANSRKDYTRQMEVAQDIAAQLEQDGGNIMG CC ************************************************** CC SEQRES VMVESHLVEGRQDKPEVYGKSITDACIGWGATEELLALLAGANKKRMARA CC ATOM VMVESHLVEGRQDKPEVYGKSITDACIGWGATEELLALLAGANKKRMAR- CC ************************************************* CC SEQRES S CC ATOM - CC SQ SEQUENCE 351 AA; MW; CN; MTHHYPTDDI KIKEVKELLP PIAHLYELPI SKEASGLVHR TRQEISDLVH GRDKRLLVII GPCSIHDPKA ALEYAERLLK LRKQYENELL IVMRVYFEKP RTTVGWKGLI NDPHLDGTFD INFGLRQARS LLLSLNNMGM PASTEFLDMI TPQYYADLIS WGAIGARTTE SQVHRELASG LSCPVGFKNG TDGNLKIAID AIGAASHSHH FLSVTKAGHS AIVHTGGNPD CHVILRGGKE PNYDAEHVSE AAEQLRAAGV TDKLMIDCSH ANSRKDYTRQ MEVAQDIAAQ LEQDGGNIMG VMVESHLVEG RQDKPEVYGK SITDACIGWG ATEELLALLA GANKKRMARA S //