ID 4HMQA STANDARD; PRT; 328 AA. DT CONVERTED FROM PDB (SEQRES) 4HMQ DE Iron-compound ABC transporter, iron compound-binding protein OS Streptococcus pneumoniae CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.100 CC R-Factor 0.202 FT #SUB 192 205 LYS A 93 106 LYS B Protein A 5 FT #SUB 195 208 LYS A 98 111 ASP B Protein S 3 FT #SUB 231 244 GLU A 104 117 ASN B Protein S 1 FT #SUB 231 244 GLU A 106 119 GLU B Protein S 2 FT #SUB 231 244 GLU A 107 120 ALA B Protein S 5 FT #SUB 234 247 LYS A 106 119 GLU B Protein S 5 FT #HET 43 56 GLU A 8 408 CD A S 3 FT #HET 50 63 TRP A 1 401 FCE A S 15 FT #HET 68 81 LYS A 7 407 CD A S 1 FT #HET 70 83 ASN A 1 401 FCE A S 5 FT #HET 71 84 TYR A 1 401 FCE A S 3 FT #HET 98 111 ASP A 7 407 CD A S 3 FT #HET 127 140 ASP A 9 409 CD A S 3 FT #HET 145 158 TRP A 1 401 FCE A S 18 FT #HET 150 163 ARG A 14 414 EDO A S 5 FT #HET 163 176 GLU A 11 411 CD A S 3 FT #HET 165 178 GLU A 12 412 CD A S 3 FT #HET 174 187 GLU A 10 410 CD A S 3 FT #HET 180 193 GLU A 4 404 CD A S 3 FT #HET 184 197 HIS A 2 402 CD A A 5 FT #HET 184 197 HIS A 13 413 CL A A 5 FT #HET 185 198 PRO A 13 413 CL A B 1 FT #HET 186 199 GLU A 13 413 CL A A 3 FT #HET 187 200 ILE A 13 413 CL A B 1 FT #HET 200 213 MET A 1 401 FCE A S 4 FT #HET 200 213 MET A 15 415 EDO A S 7 FT #HET 202 215 ASN A 15 415 EDO A S 1 FT #HET 210 223 TRP A 1 401 FCE A S 6 FT #HET 212 225 TYR A 1 401 FCE A S 8 FT #HET 218 231 ARG A 1 401 FCE A S 9 FT #HET 239 252 GLU A 6 406 CD A S 3 FT #HET 242 255 PHE A 1 401 FCE A S 13 FT #HET 273 286 GLN A 16 416 PGE A B 1 FT #HET 274 287 LYS A 16 416 PGE A B 1 FT #HET 275 288 ASP A 16 416 PGE A B 1 FT #HET 276 289 PRO A 16 416 PGE A A 6 FT #HET 279 292 GLY A 16 416 PGE A B 3 FT #HET 280 293 LYS A 16 416 PGE A S 23 FT #HET 314 327 GLU A 3 403 CD A S 3 FT #HET 314 327 GLU A 4 404 CD A S 2 FT #HET 315 328 GLU A 5 405 CD A S 3 FT DISORDER 1 25 CC SEQUENCE 303 AA (ATOM); CC KIVLDHAFGQ TILDKKPERV ATIAWGNHDV ALALGIVPVG FSKANYGVSA DKGVLPWTEE CC KIKELNGKAN LFDDLDGLNF EAISNSKPDV ILAGYSGITK EDYDTLSKIA PVAAYKSKPW CC QTLWRDMIKI DSKALGMEKE GDELIKNTEA RISKELEKHP EIKGKIKGKK VLFTMINAAD CC TSKFWIYTSK DPRANYLTDL GLVFPESLKE FESEDSFAKE ISAEEANKIN DADVIITYGD CC DKTLEALQKD PLLGKINAIK NGAVAVIPDN TPLAASCTPT PLSINYTIEE YLNLLGNACK CC NAK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MGHHHHHHMNSVKNEENTSKEHAPDKIVLDHAFGQTILDKKPERVATIAW CC ATOM -------------------------KIVLDHAFGQTILDKKPERVATIAW CC ************************* CC SEQRES GNHDVALALGIVPVGFSKANYGVSADKGVLPWTEEKIKELNGKANLFDDL CC ATOM GNHDVALALGIVPVGFSKANYGVSADKGVLPWTEEKIKELNGKANLFDDL CC ************************************************** CC SEQRES DGLNFEAISNSKPDVILAGYSGITKEDYDTLSKIAPVAAYKSKPWQTLWR CC ATOM DGLNFEAISNSKPDVILAGYSGITKEDYDTLSKIAPVAAYKSKPWQTLWR CC ************************************************** CC SEQRES DMIKIDSKALGMEKEGDELIKNTEARISKELEKHPEIKGKIKGKKVLFTM CC ATOM DMIKIDSKALGMEKEGDELIKNTEARISKELEKHPEIKGKIKGKKVLFTM CC ************************************************** CC SEQRES INAADTSKFWIYTSKDPRANYLTDLGLVFPESLKEFESEDSFAKEISAEE CC ATOM INAADTSKFWIYTSKDPRANYLTDLGLVFPESLKEFESEDSFAKEISAEE CC ************************************************** CC SEQRES ANKINDADVIITYGDDKTLEALQKDPLLGKINAIKNGAVAVIPDNTPLAA CC ATOM ANKINDADVIITYGDDKTLEALQKDPLLGKINAIKNGAVAVIPDNTPLAA CC ************************************************** CC SEQRES SCTPTPLSINYTIEEYLNLLGNACKNAK CC ATOM SCTPTPLSINYTIEEYLNLLGNACKNAK CC **************************** SQ SEQUENCE 328 AA; MW; CN; MGHHHHHHMN SVKNEENTSK EHAPDKIVLD HAFGQTILDK KPERVATIAW GNHDVALALG IVPVGFSKAN YGVSADKGVL PWTEEKIKEL NGKANLFDDL DGLNFEAISN SKPDVILAGY SGITKEDYDT LSKIAPVAAY KSKPWQTLWR DMIKIDSKAL GMEKEGDELI KNTEARISKE LEKHPEIKGK IKGKKVLFTM INAADTSKFW IYTSKDPRAN YLTDLGLVFP ESLKEFESED SFAKEISAEE ANKINDADVI ITYGDDKTLE ALQKDPLLGK INAIKNGAVA VIPDNTPLAA SCTPTPLSIN YTIEEYLNLL GNACKNAK // ID 4HMQB STANDARD; PRT; 328 AA. DT CONVERTED FROM PDB (SEQRES) 4HMQ DE Iron-compound ABC transporter, iron compound-binding protein OS Streptococcus pneumoniae CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.100 CC R-Factor 0.202 FT #SUB 93 106 LYS B 192 205 LYS A Protein S 5 FT #SUB 98 111 ASP B 195 208 LYS A Protein S 3 FT #SUB 104 117 ASN B 231 244 GLU A Protein S 1 FT #SUB 106 119 GLU B 231 244 GLU A Protein S 2 FT #SUB 106 119 GLU B 234 247 LYS A Protein S 5 FT #SUB 107 120 ALA B 231 244 GLU A Protein A 5 FT #HET 30 43 ASP B 33 417 EDO B S 8 FT #HET 43 56 GLU B 22 406 CD B S 3 FT #HET 44 57 ARG B 32 416 CL B S 1 FT #HET 50 63 TRP B 17 401 FCE B S 13 FT #HET 70 83 ASN B 17 401 FCE B S 1 FT #HET 71 84 TYR B 17 401 FCE B S 3 FT #HET 98 111 ASP B 29 413 CD B S 3 FT #HET 103 116 LEU B 31 415 CL B S 2 FT #HET 114 127 ASP B 30 414 CD B S 3 FT #HET 127 140 ASP B 18 402 CD B S 3 FT #HET 127 140 ASP B 31 415 CL B S 1 FT #HET 145 158 TRP B 17 401 FCE B S 24 FT #HET 151 164 ASP B 24 408 CD B S 3 FT #HET 154 167 LYS B 34 418 EDO B S 1 FT #HET 158 171 LYS B 33 417 EDO B S 1 FT #HET 171 184 LYS B 19 403 CD B S 2 FT #HET 171 184 LYS B 34 418 EDO B S 1 FT #HET 174 187 GLU B 19 403 CD B S 3 FT #HET 180 193 GLU B 23 407 CD B S 3 FT #HET 200 213 MET B 17 401 FCE B S 5 FT #HET 200 213 MET B 35 419 EDO B S 8 FT #HET 201 214 ILE B 35 419 EDO B B 2 FT #HET 202 215 ASN B 35 419 EDO B A 3 FT #HET 210 223 TRP B 17 401 FCE B S 7 FT #HET 212 225 TYR B 17 401 FCE B S 9 FT #HET 218 231 ARG B 17 401 FCE B S 8 FT #HET 235 248 GLU B 25 409 CD B S 3 FT #HET 242 255 PHE B 17 401 FCE B S 12 FT #HET 250 263 GLU B 26 410 CD B S 3 FT #HET 265 278 ASP B 27 411 CD B S 1 FT #HET 266 279 ASP B 27 411 CD B S 3 FT #HET 267 280 LYS B 27 411 CD B S 1 FT #HET 273 286 GLN B 36 420 PGE B B 3 FT #HET 274 287 LYS B 36 420 PGE B B 3 FT #HET 275 288 ASP B 36 420 PGE B B 4 FT #HET 276 289 PRO B 36 420 PGE B B 1 FT #HET 279 292 GLY B 36 420 PGE B B 4 FT #HET 280 293 LYS B 36 420 PGE B S 11 FT #HET 314 327 GLU B 21 405 CD B S 3 FT #HET 314 327 GLU B 23 407 CD B S 2 FT #HET 315 328 GLU B 20 404 CD B S 3 FT #HET 327 340 ALA B 28 412 CD B B 1 FT DISORDER 1 25 CC SEQUENCE 303 AA (ATOM); CC KIVLDHAFGQ TILDKKPERV ATIAWGNHDV ALALGIVPVG FSKANYGVSA DKGVLPWTEE CC KIKELNGKAN LFDDLDGLNF EAISNSKPDV ILAGYSGITK EDYDTLSKIA PVAAYKSKPW CC QTLWRDMIKI DSKALGMEKE GDELIKNTEA RISKELEKHP EIKGKIKGKK VLFTMINAAD CC TSKFWIYTSK DPRANYLTDL GLVFPESLKE FESEDSFAKE ISAEEANKIN DADVIITYGD CC DKTLEALQKD PLLGKINAIK NGAVAVIPDN TPLAASCTPT PLSINYTIEE YLNLLGNACK CC NAK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MGHHHHHHMNSVKNEENTSKEHAPDKIVLDHAFGQTILDKKPERVATIAW CC ATOM -------------------------KIVLDHAFGQTILDKKPERVATIAW CC ************************* CC SEQRES GNHDVALALGIVPVGFSKANYGVSADKGVLPWTEEKIKELNGKANLFDDL CC ATOM GNHDVALALGIVPVGFSKANYGVSADKGVLPWTEEKIKELNGKANLFDDL CC ************************************************** CC SEQRES DGLNFEAISNSKPDVILAGYSGITKEDYDTLSKIAPVAAYKSKPWQTLWR CC ATOM DGLNFEAISNSKPDVILAGYSGITKEDYDTLSKIAPVAAYKSKPWQTLWR CC ************************************************** CC SEQRES DMIKIDSKALGMEKEGDELIKNTEARISKELEKHPEIKGKIKGKKVLFTM CC ATOM DMIKIDSKALGMEKEGDELIKNTEARISKELEKHPEIKGKIKGKKVLFTM CC ************************************************** CC SEQRES INAADTSKFWIYTSKDPRANYLTDLGLVFPESLKEFESEDSFAKEISAEE CC ATOM INAADTSKFWIYTSKDPRANYLTDLGLVFPESLKEFESEDSFAKEISAEE CC ************************************************** CC SEQRES ANKINDADVIITYGDDKTLEALQKDPLLGKINAIKNGAVAVIPDNTPLAA CC ATOM ANKINDADVIITYGDDKTLEALQKDPLLGKINAIKNGAVAVIPDNTPLAA CC ************************************************** CC SEQRES SCTPTPLSINYTIEEYLNLLGNACKNAK CC ATOM SCTPTPLSINYTIEEYLNLLGNACKNAK CC **************************** SQ SEQUENCE 328 AA; MW; CN; MGHHHHHHMN SVKNEENTSK EHAPDKIVLD HAFGQTILDK KPERVATIAW GNHDVALALG IVPVGFSKAN YGVSADKGVL PWTEEKIKEL NGKANLFDDL DGLNFEAISN SKPDVILAGY SGITKEDYDT LSKIAPVAAY KSKPWQTLWR DMIKIDSKAL GMEKEGDELI KNTEARISKE LEKHPEIKGK IKGKKVLFTM INAADTSKFW IYTSKDPRAN YLTDLGLVFP ESLKEFESED SFAKEISAEE ANKINDADVI ITYGDDKTLE ALQKDPLLGK INAIKNGAVA VIPDNTPLAA SCTPTPLSIN YTIEEYLNLL GNACKNAK //