ID 3Q80A STANDARD; PRT; 231 AA. DT CONVERTED FROM PDB (SEQRES) 3Q80 DE 2-C-methyl-D-erythritol 4-phosphate cytidyltransferase OS Mycobacterium tuberculosis CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.000 CC R-Factor 0.167 FT #SUB 20 20 ARG A 137 137 PRO B Protein S 1 FT #SUB 110 110 ARG A 140 140 ASP B Protein S 4 FT #SUB 137 137 PRO A 20 20 ARG B Protein S 1 FT #SUB 138 138 LEU A 142 142 ILE B Protein S 1 FT #SUB 139 139 SER A 215 215 LYS B Protein B 2 FT #SUB 139 139 SER A 217 217 THR B Protein S 4 FT #SUB 140 140 ASP A 110 110 ARG B Protein S 4 FT #SUB 140 140 ASP A 162 162 ALA B Protein S 1 FT #SUB 140 140 ASP A 163 163 VAL B Protein S 4 FT #SUB 141 141 THR A 161 161 ARG B Protein B 1 FT #SUB 141 141 THR A 162 162 ALA B Protein B 2 FT #SUB 141 141 THR A 163 163 VAL B Protein A 8 FT #SUB 141 141 THR A 191 191 THR B Protein S 6 FT #SUB 141 141 THR A 192 192 ASP B Protein S 2 FT #SUB 142 142 ILE A 138 138 LEU B Protein S 1 FT #SUB 142 142 ILE A 161 161 ARG B Protein A 4 FT #SUB 142 142 ILE A 162 162 ALA B Protein S 1 FT #SUB 143 143 LYS A 160 160 LEU B Protein B 4 FT #SUB 143 143 LYS A 161 161 ARG B Protein B 4 FT #SUB 143 143 LYS A 163 163 VAL B Protein S 2 FT #SUB 143 143 LYS A 192 192 ASP B Protein S 4 FT #SUB 143 143 LYS A 194 194 ALA B Protein S 2 FT #SUB 143 143 LYS A 195 195 SER B Protein S 2 FT #SUB 143 143 LYS A 198 198 GLU B Protein S 5 FT #SUB 144 144 ALA A 159 159 GLY B Protein B 2 FT #SUB 144 144 ALA A 160 160 LEU B Protein B 1 FT #SUB 145 145 VAL A 159 159 GLY B Protein B 2 FT #SUB 148 148 ASN A 205 205 GLN B Protein B 1 FT #SUB 149 149 GLY A 204 204 VAL B Protein B 1 FT #SUB 149 149 GLY A 205 205 GLN B Protein B 7 FT #SUB 149 149 GLY A 206 206 VAL B Protein B 7 FT #SUB 150 150 VAL A 203 203 GLN B Protein S 2 FT #SUB 150 150 VAL A 204 204 VAL B Protein B 2 FT #SUB 150 150 VAL A 205 205 GLN B Protein S 1 FT #SUB 151 151 VAL A 198 198 GLU B Protein S 2 FT #SUB 151 151 VAL A 204 204 VAL B Protein A 6 FT #SUB 151 151 VAL A 206 206 VAL B Protein S 1 FT #SUB 153 153 GLY A 198 198 GLU B Protein B 2 FT #SUB 154 154 THR A 195 195 SER B Protein S 3 FT #SUB 154 154 THR A 198 198 GLU B Protein A 5 FT #SUB 157 157 ARG A 191 191 THR B Protein S 5 FT #SUB 159 159 GLY A 144 144 ALA B Protein B 2 FT #SUB 159 159 GLY A 145 145 VAL B Protein B 2 FT #SUB 160 160 LEU A 142 142 ILE B Protein S 1 FT #SUB 160 160 LEU A 143 143 LYS B Protein A 4 FT #SUB 160 160 LEU A 144 144 ALA B Protein S 1 FT #SUB 161 161 ARG A 141 141 THR B Protein B 1 FT #SUB 161 161 ARG A 142 142 ILE B Protein B 4 FT #SUB 161 161 ARG A 143 143 LYS B Protein B 4 FT #SUB 161 161 ARG A 145 145 VAL B Protein S 1 FT #SUB 162 162 ALA A 140 140 ASP B Protein S 1 FT #SUB 162 162 ALA A 141 141 THR B Protein B 2 FT #SUB 162 162 ALA A 142 142 ILE B Protein B 1 FT #SUB 163 163 VAL A 140 140 ASP B Protein B 3 FT #SUB 163 163 VAL A 141 141 THR B Protein A 9 FT #SUB 191 191 THR A 141 141 THR B Protein A 6 FT #SUB 191 191 THR A 157 157 ARG B Protein S 2 FT #SUB 192 192 ASP A 141 141 THR B Protein S 2 FT #SUB 192 192 ASP A 143 143 LYS B Protein S 4 FT #SUB 194 194 ALA A 143 143 LYS B Protein S 2 FT #SUB 195 195 SER A 143 143 LYS B Protein A 2 FT #SUB 195 195 SER A 154 154 THR B Protein S 3 FT #SUB 198 198 GLU A 143 143 LYS B Protein S 5 FT #SUB 198 198 GLU A 151 151 VAL B Protein S 2 FT #SUB 198 198 GLU A 153 153 GLY B Protein S 1 FT #SUB 198 198 GLU A 154 154 THR B Protein S 5 FT #SUB 203 203 GLN A 150 150 VAL B Protein S 3 FT #SUB 204 204 VAL A 149 149 GLY B Protein B 1 FT #SUB 204 204 VAL A 150 150 VAL B Protein B 2 FT #SUB 204 204 VAL A 151 151 VAL B Protein A 6 FT #SUB 205 205 GLN A 148 148 ASN B Protein S 3 FT #SUB 205 205 GLN A 149 149 GLY B Protein A 9 FT #SUB 205 205 GLN A 150 150 VAL B Protein S 1 FT #SUB 206 206 VAL A 149 149 GLY B Protein A 7 FT #SUB 206 206 VAL A 151 151 VAL B Protein S 1 FT #SUB 211 211 PRO A 220 220 LEU B Protein A 3 FT #SUB 212 212 LEU A 220 220 LEU B Protein B 1 FT #SUB 215 215 LYS A 139 139 SER B Protein S 2 FT #SUB 217 217 THR A 139 139 SER B Protein S 4 FT #SUB 220 220 LEU A 211 211 PRO B Protein S 3 FT #SUB 220 220 LEU A 224 224 LEU B Protein B 1 FT #SUB 223 223 LEU A 228 228 ILE B Protein S 1 FT #SUB 224 224 LEU A 220 220 LEU B Protein S 1 FT #SUB 224 224 LEU A 224 224 LEU B Protein A 3 FT #SUB 228 228 ILE A 220 220 LEU B Protein S 1 FT #SUB 228 228 ILE A 223 223 LEU B Protein S 1 FT #HET 13 13 PRO A 1 500 CDM A A 17 FT #HET 14 14 ALA A 1 500 CDM A B 7 FT #HET 15 15 ALA A 1 500 CDM A A 14 FT #HET 16 16 GLY A 1 500 CDM A B 11 FT #HET 16 16 GLY A 3 233 CL A B 2 FT #HET 17 17 SER A 3 233 CL A B 1 FT #HET 17 17 SER A 4 234 CL A S 1 FT #HET 18 18 GLY A 3 233 CL A B 2 FT #HET 18 18 GLY A 4 234 CL A B 1 FT #HET 19 19 GLU A 4 234 CL A A 3 FT #HET 20 20 ARG A 4 234 CL A A 2 FT #HET 27 27 LYS A 1 500 CDM A S 3 FT #HET 27 27 LYS A 3 233 CL A S 2 FT #HET 80 80 GLY A 1 500 CDM A B 3 FT #HET 81 81 SER A 1 500 CDM A B 2 FT #HET 82 82 ASN A 1 500 CDM A B 8 FT #HET 83 83 ARG A 1 500 CDM A A 13 FT #HET 86 86 THR A 1 500 CDM A S 10 FT #HET 107 107 ASP A 1 500 CDM A S 11 FT #HET 108 108 ALA A 1 500 CDM A A 3 FT #HET 109 109 ALA A 1 500 CDM A A 2 FT #HET 110 110 ARG A 1 500 CDM A S 6 FT #HET 140 140 ASP A 5 501 CDM B A 3 FT #HET 141 141 THR A 5 501 CDM B A 11 FT #HET 157 157 ARG A 5 501 CDM B S 9 FT #HET 163 163 VAL A 1 500 CDM A A 5 FT #HET 165 165 THR A 1 500 CDM A S 2 FT #HET 191 191 THR A 1 500 CDM A A 6 FT #HET 192 192 ASP A 1 500 CDM A S 1 FT #HET 215 215 LYS A 1 500 CDM A S 10 FT DISORDER 1 5 FT DISORDER 96 98 FT DISORDER 184 188 CC SEQUENCE 218 AA (ATOM); CC GEVVAIVPAA GSGERLAVGV PKAFYQLDGQ TLIERAVDGL LDSGVVDTVV VAVPADRTDE CC ARQILGHRAM IVAGGSNRTD TVNLALTVLS EPEFVLVHDA ARALTPPALV ARVVEALRDG CC YAAVVPVLPL SDTIKAVDAN GVVLGTPERA GLRAVQTPQG FTTDLLLRSY QRGSLEYTDD CC ASLVEHIGGQ VQVVDGDPLA FKITTKLDLL LAQAIVRG CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VVREAGEVVAIVPAAGSGERLAVGVPKAFYQLDGQTLIERAVDGLLDSGV CC ATOM -----GEVVAIVPAAGSGERLAVGVPKAFYQLDGQTLIERAVDGLLDSGV CC ********************************************* CC SEQRES VDTVVVAVPADRTDEARQILGHRAMIVAGGSNRTDTVNLALTVLSGTAEP CC ATOM VDTVVVAVPADRTDEARQILGHRAMIVAGGSNRTDTVNLALTVLS---EP CC ********************************************* ** CC SEQRES EFVLVHDAARALTPPALVARVVEALRDGYAAVVPVLPLSDTIKAVDANGV CC ATOM EFVLVHDAARALTPPALVARVVEALRDGYAAVVPVLPLSDTIKAVDANGV CC ************************************************** CC SEQRES VLGTPERAGLRAVQTPQGFTTDLLLRSYQRGSLDLPAAEYTDDASLVEHI CC ATOM VLGTPERAGLRAVQTPQGFTTDLLLRSYQRGSL-----EYTDDASLVEHI CC ********************************* ************ CC SEQRES GGQVQVVDGDPLAFKITTKLDLLLAQAIVRG CC ATOM GGQVQVVDGDPLAFKITTKLDLLLAQAIVRG CC ******************************* SQ SEQUENCE 231 AA; MW; CN; VVREAGEVVA IVPAAGSGER LAVGVPKAFY QLDGQTLIER AVDGLLDSGV VDTVVVAVPA DRTDEARQIL GHRAMIVAGG SNRTDTVNLA LTVLSGTAEP EFVLVHDAAR ALTPPALVAR VVEALRDGYA AVVPVLPLSD TIKAVDANGV VLGTPERAGL RAVQTPQGFT TDLLLRSYQR GSLDLPAAEY TDDASLVEHI GGQVQVVDGD PLAFKITTKL DLLLAQAIVR G // ID 3Q80B STANDARD; PRT; 231 AA. DT CONVERTED FROM PDB (SEQRES) 3Q80 DE 2-C-methyl-D-erythritol 4-phosphate cytidyltransferase OS Mycobacterium tuberculosis CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.000 CC R-Factor 0.167 FT #SUB 20 20 ARG B 137 137 PRO A Protein S 1 FT #SUB 110 110 ARG B 140 140 ASP A Protein S 4 FT #SUB 137 137 PRO B 20 20 ARG A Protein S 1 FT #SUB 138 138 LEU B 142 142 ILE A Protein S 1 FT #SUB 139 139 SER B 215 215 LYS A Protein B 2 FT #SUB 139 139 SER B 217 217 THR A Protein S 4 FT #SUB 140 140 ASP B 110 110 ARG A Protein S 4 FT #SUB 140 140 ASP B 162 162 ALA A Protein S 1 FT #SUB 140 140 ASP B 163 163 VAL A Protein S 3 FT #SUB 141 141 THR B 161 161 ARG A Protein B 1 FT #SUB 141 141 THR B 162 162 ALA A Protein B 2 FT #SUB 141 141 THR B 163 163 VAL A Protein A 9 FT #SUB 141 141 THR B 191 191 THR A Protein S 6 FT #SUB 141 141 THR B 192 192 ASP A Protein S 2 FT #SUB 142 142 ILE B 138 138 LEU A Protein S 1 FT #SUB 142 142 ILE B 160 160 LEU A Protein S 1 FT #SUB 142 142 ILE B 161 161 ARG A Protein A 4 FT #SUB 142 142 ILE B 162 162 ALA A Protein S 1 FT #SUB 143 143 LYS B 160 160 LEU A Protein B 4 FT #SUB 143 143 LYS B 161 161 ARG A Protein B 4 FT #SUB 143 143 LYS B 192 192 ASP A Protein S 4 FT #SUB 143 143 LYS B 194 194 ALA A Protein S 2 FT #SUB 143 143 LYS B 195 195 SER A Protein S 2 FT #SUB 143 143 LYS B 198 198 GLU A Protein S 5 FT #SUB 144 144 ALA B 159 159 GLY A Protein B 2 FT #SUB 144 144 ALA B 160 160 LEU A Protein B 1 FT #SUB 145 145 VAL B 159 159 GLY A Protein B 2 FT #SUB 145 145 VAL B 161 161 ARG A Protein S 1 FT #SUB 148 148 ASN B 205 205 GLN A Protein B 3 FT #SUB 149 149 GLY B 204 204 VAL A Protein B 1 FT #SUB 149 149 GLY B 205 205 GLN A Protein B 9 FT #SUB 149 149 GLY B 206 206 VAL A Protein B 7 FT #SUB 150 150 VAL B 203 203 GLN A Protein S 3 FT #SUB 150 150 VAL B 204 204 VAL A Protein B 2 FT #SUB 150 150 VAL B 205 205 GLN A Protein S 1 FT #SUB 151 151 VAL B 198 198 GLU A Protein S 2 FT #SUB 151 151 VAL B 204 204 VAL A Protein A 6 FT #SUB 151 151 VAL B 206 206 VAL A Protein S 1 FT #SUB 153 153 GLY B 198 198 GLU A Protein B 1 FT #SUB 154 154 THR B 195 195 SER A Protein S 3 FT #SUB 154 154 THR B 198 198 GLU A Protein A 5 FT #SUB 157 157 ARG B 191 191 THR A Protein S 2 FT #SUB 159 159 GLY B 144 144 ALA A Protein B 2 FT #SUB 159 159 GLY B 145 145 VAL A Protein B 2 FT #SUB 160 160 LEU B 143 143 LYS A Protein A 4 FT #SUB 160 160 LEU B 144 144 ALA A Protein S 1 FT #SUB 161 161 ARG B 141 141 THR A Protein B 1 FT #SUB 161 161 ARG B 142 142 ILE A Protein B 4 FT #SUB 161 161 ARG B 143 143 LYS A Protein B 4 FT #SUB 162 162 ALA B 140 140 ASP A Protein S 1 FT #SUB 162 162 ALA B 141 141 THR A Protein B 2 FT #SUB 162 162 ALA B 142 142 ILE A Protein B 1 FT #SUB 163 163 VAL B 140 140 ASP A Protein B 4 FT #SUB 163 163 VAL B 141 141 THR A Protein A 8 FT #SUB 163 163 VAL B 143 143 LYS A Protein S 2 FT #SUB 191 191 THR B 141 141 THR A Protein A 6 FT #SUB 191 191 THR B 157 157 ARG A Protein S 5 FT #SUB 192 192 ASP B 141 141 THR A Protein S 2 FT #SUB 192 192 ASP B 143 143 LYS A Protein S 4 FT #SUB 194 194 ALA B 143 143 LYS A Protein S 2 FT #SUB 195 195 SER B 143 143 LYS A Protein A 2 FT #SUB 195 195 SER B 154 154 THR A Protein S 3 FT #SUB 198 198 GLU B 143 143 LYS A Protein S 5 FT #SUB 198 198 GLU B 151 151 VAL A Protein S 2 FT #SUB 198 198 GLU B 153 153 GLY A Protein S 2 FT #SUB 198 198 GLU B 154 154 THR A Protein S 5 FT #SUB 203 203 GLN B 150 150 VAL A Protein S 2 FT #SUB 204 204 VAL B 149 149 GLY A Protein B 1 FT #SUB 204 204 VAL B 150 150 VAL A Protein B 2 FT #SUB 204 204 VAL B 151 151 VAL A Protein A 6 FT #SUB 205 205 GLN B 148 148 ASN A Protein S 1 FT #SUB 205 205 GLN B 149 149 GLY A Protein A 7 FT #SUB 205 205 GLN B 150 150 VAL A Protein S 1 FT #SUB 206 206 VAL B 149 149 GLY A Protein A 7 FT #SUB 206 206 VAL B 151 151 VAL A Protein S 1 FT #SUB 211 211 PRO B 220 220 LEU A Protein A 3 FT #SUB 215 215 LYS B 139 139 SER A Protein S 2 FT #SUB 217 217 THR B 139 139 SER A Protein S 4 FT #SUB 220 220 LEU B 211 211 PRO A Protein S 3 FT #SUB 220 220 LEU B 212 212 LEU A Protein S 1 FT #SUB 220 220 LEU B 224 224 LEU A Protein B 1 FT #SUB 220 220 LEU B 228 228 ILE A Protein S 1 FT #SUB 223 223 LEU B 228 228 ILE A Protein S 1 FT #SUB 224 224 LEU B 220 220 LEU A Protein S 1 FT #SUB 224 224 LEU B 224 224 LEU A Protein S 3 FT #SUB 228 228 ILE B 223 223 LEU A Protein S 1 FT #HET 13 13 PRO B 5 501 CDM B A 15 FT #HET 14 14 ALA B 5 501 CDM B B 4 FT #HET 15 15 ALA B 5 501 CDM B A 16 FT #HET 16 16 GLY B 5 501 CDM B B 12 FT #HET 16 16 GLY B 7 233 CL B B 2 FT #HET 17 17 SER B 7 233 CL B B 1 FT #HET 18 18 GLY B 7 233 CL B B 2 FT #HET 18 18 GLY B 8 234 CL B B 3 FT #HET 19 19 GLU B 8 234 CL B B 1 FT #HET 20 20 ARG B 8 234 CL B A 3 FT #HET 21 21 LEU B 8 234 CL B B 1 FT #HET 27 27 LYS B 5 501 CDM B S 3 FT #HET 27 27 LYS B 7 233 CL B S 2 FT #HET 27 27 LYS B 8 234 CL B S 3 FT #HET 80 80 GLY B 5 501 CDM B B 3 FT #HET 81 81 SER B 5 501 CDM B B 3 FT #HET 82 82 ASN B 5 501 CDM B B 10 FT #HET 83 83 ARG B 5 501 CDM B A 14 FT #HET 86 86 THR B 5 501 CDM B S 9 FT #HET 107 107 ASP B 5 501 CDM B S 11 FT #HET 108 108 ALA B 5 501 CDM B A 2 FT #HET 109 109 ALA B 5 501 CDM B A 2 FT #HET 110 110 ARG B 5 501 CDM B S 6 FT #HET 139 139 SER B 1 500 CDM A B 1 FT #HET 140 140 ASP B 1 500 CDM A A 3 FT #HET 141 141 THR B 1 500 CDM A A 11 FT #HET 157 157 ARG B 1 500 CDM A S 10 FT #HET 163 163 VAL B 5 501 CDM B B 3 FT #HET 165 165 THR B 5 501 CDM B S 2 FT #HET 191 191 THR B 5 501 CDM B A 6 FT #HET 192 192 ASP B 5 501 CDM B S 1 FT #HET 215 215 LYS B 5 501 CDM B S 11 FT DISORDER 1 5 FT DISORDER 95 98 FT DISORDER 181 184 CC SEQUENCE 218 AA (ATOM); CC GEVVAIVPAA GSGERLAVGV PKAFYQLDGQ TLIERAVDGL LDSGVVDTVV VAVPADRTDE CC ARQILGHRAM IVAGGSNRTD TVNLALTVLE PEFVLVHDAA RALTPPALVA RVVEALRDGY CC AAVVPVLPLS DTIKAVDANG VVLGTPERAG LRAVQTPQGF TTDLLLRSYQ RLPAAEYTDD CC ASLVEHIGGQ VQVVDGDPLA FKITTKLDLL LAQAIVRG CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VVREAGEVVAIVPAAGSGERLAVGVPKAFYQLDGQTLIERAVDGLLDSGV CC ATOM -----GEVVAIVPAAGSGERLAVGVPKAFYQLDGQTLIERAVDGLLDSGV CC ********************************************* CC SEQRES VDTVVVAVPADRTDEARQILGHRAMIVAGGSNRTDTVNLALTVLSGTAEP CC ATOM VDTVVVAVPADRTDEARQILGHRAMIVAGGSNRTDTVNLALTVL----EP CC ******************************************** ** CC SEQRES EFVLVHDAARALTPPALVARVVEALRDGYAAVVPVLPLSDTIKAVDANGV CC ATOM EFVLVHDAARALTPPALVARVVEALRDGYAAVVPVLPLSDTIKAVDANGV CC ************************************************** CC SEQRES VLGTPERAGLRAVQTPQGFTTDLLLRSYQRGSLDLPAAEYTDDASLVEHI CC ATOM VLGTPERAGLRAVQTPQGFTTDLLLRSYQR----LPAAEYTDDASLVEHI CC ****************************** **************** CC SEQRES GGQVQVVDGDPLAFKITTKLDLLLAQAIVRG CC ATOM GGQVQVVDGDPLAFKITTKLDLLLAQAIVRG CC ******************************* SQ SEQUENCE 231 AA; MW; CN; VVREAGEVVA IVPAAGSGER LAVGVPKAFY QLDGQTLIER AVDGLLDSGV VDTVVVAVPA DRTDEARQIL GHRAMIVAGG SNRTDTVNLA LTVLSGTAEP EFVLVHDAAR ALTPPALVAR VVEALRDGYA AVVPVLPLSD TIKAVDANGV VLGTPERAGL RAVQTPQGFT TDLLLRSYQR GSLDLPAAEY TDDASLVEHI GGQVQVVDGD PLAFKITTKL DLLLAQAIVR G //