ID 2BQ1E STANDARD; PRT; 714 AA. DT CONVERTED FROM PDB (SEQRES) 2BQ1 DE RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE 2 ALPHA SUBUNIT OS SALMONELLA TYPHIMURIUM CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.990 CC R-Factor 0.265 FT #SUB 187 187 MET E 198 198 LEU F Protein S 1 FT #SUB 187 187 MET E 199 199 GLN F Protein A 8 FT #SUB 187 187 MET E 202 202 LYS F Protein S 2 FT #SUB 187 187 MET E 244 244 TYR F Protein S 4 FT #SUB 188 188 GLU E 199 199 GLN F Protein A 2 FT #SUB 190 190 ILE E 198 198 LEU F Protein S 1 FT #SUB 190 190 ILE E 244 244 TYR F Protein S 1 FT #SUB 191 191 GLY E 195 195 ASN F Protein B 1 FT #SUB 191 191 GLY E 198 198 LEU F Protein B 1 FT #SUB 192 192 ARG E 403 403 ASN F Protein S 5 FT #SUB 192 192 ARG E 404 404 LEU F Protein S 3 FT #SUB 192 192 ARG E 405 405 ASP F Protein S 1 FT #SUB 195 195 ASN E 191 191 GLY F Protein S 1 FT #SUB 195 195 ASN E 404 404 LEU F Protein S 4 FT #SUB 198 198 LEU E 187 187 MET F Protein B 2 FT #SUB 198 198 LEU E 191 191 GLY F Protein S 1 FT #SUB 198 198 LEU E 194 194 VAL F Protein S 1 FT #SUB 198 198 LEU E 237 237 MET F Protein S 3 FT #SUB 199 199 GLN E 187 187 MET F Protein S 6 FT #SUB 199 199 GLN E 188 188 GLU F Protein S 5 FT #SUB 202 202 LYS E 187 187 MET F Protein S 2 FT #SUB 222 222 LYS E 203 203 ARG F Protein S 1 FT #SUB 233 233 PRO E 244 244 TYR F Protein S 1 FT #SUB 234 234 VAL E 244 244 TYR F Protein S 2 FT #SUB 236 236 LYS E 240 240 ASP F Protein S 2 FT #SUB 237 237 MET E 198 198 LEU F Protein S 1 FT #SUB 237 237 MET E 244 244 TYR F Protein S 1 FT #SUB 240 240 ASP E 236 236 LYS F Protein S 2 FT #SUB 240 240 ASP E 240 240 ASP F Protein S 3 FT #SUB 244 244 TYR E 187 187 MET F Protein S 3 FT #SUB 244 244 TYR E 190 190 ILE F Protein S 1 FT #SUB 244 244 TYR E 233 233 PRO F Protein S 4 FT #SUB 244 244 TYR E 234 234 VAL F Protein S 3 FT #SUB 244 244 TYR E 237 237 MET F Protein S 1 FT #SUB 401 401 ASP E 452 452 ARG F Protein S 1 FT #SUB 402 402 ASP E 452 452 ARG F Protein S 3 FT #SUB 402 402 ASP E 453 453 SER F Protein B 6 FT #SUB 403 403 ASN E 192 192 ARG F Protein B 4 FT #SUB 403 403 ASN E 452 452 ARG F Protein A 3 FT #SUB 403 403 ASN E 455 455 PRO F Protein S 1 FT #SUB 404 404 LEU E 195 195 ASN F Protein S 8 FT #SUB 405 405 ASP E 405 405 ASP F Protein S 1 FT #SUB 452 452 ARG E 401 401 ASP F Protein S 1 FT #SUB 452 452 ARG E 402 402 ASP F Protein A 7 FT #SUB 452 452 ARG E 403 403 ASN F Protein B 3 FT #SUB 453 453 SER E 402 402 ASP F Protein B 1 FT #SUB 13 13 THR E 47 47 THR I Protein S 1 FT #SUB 13 13 THR E 177 177 LYS I Protein S 3 FT #SUB 14 14 MET E 175 175 ARG I Protein S 2 FT #SUB 15 15 ASP E 177 177 LYS I Protein S 1 FT #SUB 18 18 ALA E 175 175 ARG I Protein A 5 FT #SUB 18 18 ALA E 176 176 GLY I Protein A 5 FT #SUB 18 18 ALA E 177 177 LYS I Protein S 1 FT #SUB 21 21 ALA E 176 176 GLY I Protein S 2 FT #SUB 22 22 MET E 174 174 SER I Protein S 1 FT #SUB 22 22 MET E 175 175 ARG I Protein S 4 FT #SUB 300 300 ALA E 317 317 TRP I Protein A 11 FT #SUB 301 301 LYS E 318 318 ASN I Protein S 2 FT #SUB 301 301 LYS E 319 319 PHE I Protein S 2 FT #SUB 348 348 ARG E 312 312 THR I Protein S 3 FT #SUB 348 348 ARG E 313 313 GLU I Protein S 1 FT #SUB 348 348 ARG E 314 314 ASP I Protein S 3 FT #SUB 348 348 ARG E 317 317 TRP I Protein S 10 FT #SUB 351 351 PHE E 317 317 TRP I Protein S 2 FT #SUB 352 352 GLN E 310 310 VAL I Protein S 3 FT #SUB 352 352 GLN E 311 311 GLU I Protein S 4 FT #SUB 352 352 GLN E 312 312 THR I Protein S 1 FT #SUB 616 616 LYS E 40 40 ASN I Protein B 1 FT #SUB 616 616 LYS E 43 43 PRO I Protein A 5 FT #SUB 617 617 THR E 40 40 ASN I Protein A 6 FT #SUB 618 618 GLY E 40 40 ASN I Protein B 1 FT #SUB 619 619 ARG E 180 180 ASN I Protein S 2 FT #SUB 672 672 THR E 309 309 THR I Protein A 5 FT #SUB 672 672 THR E 310 310 VAL I Protein S 4 FT #SUB 673 673 THR E 309 309 THR I Protein A 4 FT #SUB 673 673 THR E 310 310 VAL I Protein A 9 FT #SUB 673 673 THR E 311 311 GLU I Protein S 2 FT #SUB 674 674 ARG E 310 310 VAL I Protein A 3 FT #SUB 674 674 ARG E 311 311 GLU I Protein A 5 FT #SUB 674 674 ARG E 312 312 THR I Protein S 3 FT #SUB 674 674 ARG E 313 313 GLU I Protein S 5 FT #SUB 674 674 ARG E 316 316 ASP I Protein S 5 FT #SUB 677 677 ASN E 312 312 THR I Protein S 1 FT #SUB 681 681 ILE E 316 316 ASP I Protein S 1 FT #SUB 681 681 ILE E 317 317 TRP I Protein S 4 FT #SUB 681 681 ILE E 319 319 PHE I Protein S 1 FT #SUB 685 685 ARG E 319 319 PHE I Protein S 22 FT #HET 185 185 ASP E 1 1700 DGT E A 13 FT #HET 186 186 ASN E 1 1700 DGT E A 10 FT #HET 187 187 MET E 1 1700 DGT E A 10 FT #HET 190 190 ILE E 1 1700 DGT E S 3 FT #HET 202 202 LYS E 3 1700 DGT F A 7 FT #HET 214 214 LEU E 1 1700 DGT E S 1 FT #HET 215 215 ARG E 1 1700 DGT E S 18 FT #HET 221 221 ILE E 1 1700 DGT E S 9 FT #HET 222 222 LYS E 1 1700 DGT E A 7 FT #HET 244 244 TYR E 3 1700 DGT F A 5 FT #HET 246 246 ASN E 3 1700 DGT F B 3 FT DISORDER 1 11 FT DISORDER 247 251 FT DISORDER 275 282 FT DISORDER 701 714 CC Miss-BB 2 CC Miss-SC 2 CC SEQUENCE 676 AA (ATOM); CC ETMDYHALNA MLNLYDKAGH IQFDKDQQAI DAFFATHVRP HSVTFASQHE RLGTLVREGY CC YDDAVLARYD RAFVLRLFEH AHASGFRFQT FLGAWKFYTS YTLKTFDGKR YLEHFEDRVT CC MVALTLAQGD ETLATQLTDE MLSGRFQPAT PTFLNCGKQQ RGELVSCFLL RIEDNMESIG CC RAVNSALQLS KRGGGVAFLL SNLREAGAPI KRIENQSSGV IPVMKMLEDA FSYANQGAGA CC VYLHAHHPDI LRFLDTKRIK TLSLGVVIPD ITFRLAKENA QMALFSPYDI QRRYGKPFGD CC IAISERYDEL IADPHVRKTY INARDFFQTL AEIQFESGYP YIMFEDTVNR ANPIAGRINM CC SNLCSEILQV NSASRYDDNL DYTHIGHDIS CNLGSLNIAH VMDSPDIGRT VETAIRGLTA CC VSDMSHIRSV PSIAAGNAAS HAIGLGQMNL HGYLAREGIA YGSPEALDFT NLYFYTITWH CC AVHTSMRLAR ERGKTFAGFA QSRYASGDYF TQYLQDDWQP KTAKVRALFA RSGITLPTRE CC MWLKLRDDVM RYGIYNQNLQ AVPPTGSISY INHATSSIHP IVAKIEIRKE GKTGRVYYPA CC PFMTNENLDM YQDAYDIGPE KIIDTYAEAT RHVDQGLSLT LFFPDTATTR DINKAQIYAW CC RKGIKSLYYI RLRQLA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MATTTPERVMQETMDYHALNAMLNLYDKAGHIQFDKDQQAIDAFFATHVR CC ATOM -----------ETMDYHALNAMLNLYDKAGHIQFDKDQQAIDAFFATHVR CC *************************************** CC SEQRES PHSVTFASQHERLGTLVREGYYDDAVLARYDRAFVLRLFEHAHASGFRFQ CC ATOM PHSVTFASQHERLGTLVREGYYDDAVLARYDRAFVLRLFEHAHASGFRFQ CC ************************************************** CC SEQRES TFLGAWKFYTSYTLKTFDGKRYLEHFEDRVTMVALTLAQGDETLATQLTD CC ATOM TFLGAWKFYTSYTLKTFDGKRYLEHFEDRVTMVALTLAQGDETLATQLTD CC ************************************************** CC SEQRES EMLSGRFQPATPTFLNCGKQQRGELVSCFLLRIEDNMESIGRAVNSALQL CC ATOM EMLSGRFQPATPTFLNCGKQQRGELVSCFLLRIEDNMESIGRAVNSALQL CC ************************************************** CC SEQRES SKRGGGVAFLLSNLREAGAPIKRIENQSSGVIPVMKMLEDAFSYANQLGA CC ATOM SKRGGGVAFLLSNLREAGAPIKRIENQSSGVIPVMKMLEDAFSYAN---- CC ********************************************** CC SEQRES RQGAGAVYLHAHHPDILRFLDTKRENADEKIRIKTLSLGVVIPDITFRLA CC ATOM -QGAGAVYLHAHHPDILRFLDTKR--------IKTLSLGVVIPDITFRLA CC *********************** ****************** CC SEQRES KENAQMALFSPYDIQRRYGKPFGDIAISERYDELIADPHVRKTYINARDF CC ATOM KENAQMALFSPYDIQRRYGKPFGDIAISERYDELIADPHVRKTYINARDF CC ************************************************** CC SEQRES FQTLAEIQFESGYPYIMFEDTVNRANPIAGRINMSNLCSEILQVNSASRY CC ATOM FQTLAEIQFESGYPYIMFEDTVNRANPIAGRINMSNLCSEILQVNSASRY CC ************************************************** CC SEQRES DDNLDYTHIGHDISCNLGSLNIAHVMDSPDIGRTVETAIRGLTAVSDMSH CC ATOM DDNLDYTHIGHDISCNLGSLNIAHVMDSPDIGRTVETAIRGLTAVSDMSH CC ************************************************** CC SEQRES IRSVPSIAAGNAASHAIGLGQMNLHGYLAREGIAYGSPEALDFTNLYFYT CC ATOM IRSVPSIAAGNAASHAIGLGQMNLHGYLAREGIAYGSPEALDFTNLYFYT CC ************************************************** CC SEQRES ITWHAVHTSMRLARERGKTFAGFAQSRYASGDYFTQYLQDDWQPKTAKVR CC ATOM ITWHAVHTSMRLARERGKTFAGFAQSRYASGDYFTQYLQDDWQPKTAKVR CC ************************************************** CC SEQRES ALFARSGITLPTREMWLKLRDDVMRYGIYNQNLQAVPPTGSISYINHATS CC ATOM ALFARSGITLPTREMWLKLRDDVMRYGIYNQNLQAVPPTGSISYINHATS CC ************************************************** CC SEQRES SIHPIVAKIEIRKEGKTGRVYYPAPFMTNENLDMYQDAYDIGPEKIIDTY CC ATOM SIHPIVAKIEIRKEGKTGRVYYPAPFMTNENLDMYQDAYDIGPEKIIDTY CC ************************************************** CC SEQRES AEATRHVDQGLSLTLFFPDTATTRDINKAQIYAWRKGIKSLYYIRLRQLA CC ATOM AEATRHVDQGLSLTLFFPDTATTRDINKAQIYAWRKGIKSLYYIRLRQLA CC ************************************************** CC SEQRES LEGTEIEGCVSCAL CC ATOM -------------- CC SQ SEQUENCE 714 AA; MW; CN; MATTTPERVM QETMDYHALN AMLNLYDKAG HIQFDKDQQA IDAFFATHVR PHSVTFASQH ERLGTLVREG YYDDAVLARY DRAFVLRLFE HAHASGFRFQ TFLGAWKFYT SYTLKTFDGK RYLEHFEDRV TMVALTLAQG DETLATQLTD EMLSGRFQPA TPTFLNCGKQ QRGELVSCFL LRIEDNMESI GRAVNSALQL SKRGGGVAFL LSNLREAGAP IKRIENQSSG VIPVMKMLED AFSYANQLGA RQGAGAVYLH AHHPDILRFL DTKRENADEK IRIKTLSLGV VIPDITFRLA KENAQMALFS PYDIQRRYGK PFGDIAISER YDELIADPHV RKTYINARDF FQTLAEIQFE SGYPYIMFED TVNRANPIAG RINMSNLCSE ILQVNSASRY DDNLDYTHIG HDISCNLGSL NIAHVMDSPD IGRTVETAIR GLTAVSDMSH IRSVPSIAAG NAASHAIGLG QMNLHGYLAR EGIAYGSPEA LDFTNLYFYT ITWHAVHTSM RLARERGKTF AGFAQSRYAS GDYFTQYLQD DWQPKTAKVR ALFARSGITL PTREMWLKLR DDVMRYGIYN QNLQAVPPTG SISYINHATS SIHPIVAKIE IRKEGKTGRV YYPAPFMTNE NLDMYQDAYD IGPEKIIDTY AEATRHVDQG LSLTLFFPDT ATTRDINKAQ IYAWRKGIKS LYYIRLRQLA LEGTEIEGCV SCAL // ID 2BQ1F STANDARD; PRT; 714 AA. DT CONVERTED FROM PDB (SEQRES) 2BQ1 DE RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE 2 ALPHA SUBUNIT OS SALMONELLA TYPHIMURIUM CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.990 CC R-Factor 0.265 FT #SUB 187 187 MET F 198 198 LEU E Protein S 2 FT #SUB 187 187 MET F 199 199 GLN E Protein A 6 FT #SUB 187 187 MET F 202 202 LYS E Protein S 2 FT #SUB 187 187 MET F 244 244 TYR E Protein S 3 FT #SUB 188 188 GLU F 199 199 GLN E Protein A 5 FT #SUB 190 190 ILE F 244 244 TYR E Protein S 1 FT #SUB 191 191 GLY F 195 195 ASN E Protein B 1 FT #SUB 191 191 GLY F 198 198 LEU E Protein B 1 FT #SUB 192 192 ARG F 403 403 ASN E Protein S 4 FT #SUB 194 194 VAL F 198 198 LEU E Protein S 1 FT #SUB 195 195 ASN F 191 191 GLY E Protein S 1 FT #SUB 195 195 ASN F 404 404 LEU E Protein S 8 FT #SUB 198 198 LEU F 187 187 MET E Protein S 1 FT #SUB 198 198 LEU F 190 190 ILE E Protein S 1 FT #SUB 198 198 LEU F 191 191 GLY E Protein S 1 FT #SUB 198 198 LEU F 237 237 MET E Protein S 1 FT #SUB 199 199 GLN F 187 187 MET E Protein S 8 FT #SUB 199 199 GLN F 188 188 GLU E Protein S 2 FT #SUB 202 202 LYS F 187 187 MET E Protein S 2 FT #SUB 203 203 ARG F 222 222 LYS E Protein S 1 FT #SUB 233 233 PRO F 244 244 TYR E Protein S 4 FT #SUB 234 234 VAL F 244 244 TYR E Protein S 3 FT #SUB 236 236 LYS F 240 240 ASP E Protein S 2 FT #SUB 237 237 MET F 198 198 LEU E Protein S 3 FT #SUB 237 237 MET F 244 244 TYR E Protein S 1 FT #SUB 240 240 ASP F 236 236 LYS E Protein S 2 FT #SUB 240 240 ASP F 240 240 ASP E Protein S 3 FT #SUB 244 244 TYR F 187 187 MET E Protein S 4 FT #SUB 244 244 TYR F 190 190 ILE E Protein S 1 FT #SUB 244 244 TYR F 233 233 PRO E Protein S 1 FT #SUB 244 244 TYR F 234 234 VAL E Protein S 2 FT #SUB 244 244 TYR F 237 237 MET E Protein S 1 FT #SUB 401 401 ASP F 452 452 ARG E Protein S 1 FT #SUB 402 402 ASP F 452 452 ARG E Protein A 7 FT #SUB 402 402 ASP F 453 453 SER E Protein B 1 FT #SUB 403 403 ASN F 192 192 ARG E Protein B 5 FT #SUB 403 403 ASN F 452 452 ARG E Protein A 3 FT #SUB 404 404 LEU F 192 192 ARG E Protein S 3 FT #SUB 404 404 LEU F 195 195 ASN E Protein S 4 FT #SUB 405 405 ASP F 192 192 ARG E Protein S 1 FT #SUB 405 405 ASP F 405 405 ASP E Protein S 1 FT #SUB 452 452 ARG F 401 401 ASP E Protein S 1 FT #SUB 452 452 ARG F 402 402 ASP E Protein S 3 FT #SUB 452 452 ARG F 403 403 ASN E Protein B 3 FT #SUB 453 453 SER F 402 402 ASP E Protein A 6 FT #SUB 455 455 PRO F 403 403 ASN E Protein S 1 FT #HET 185 185 ASP F 3 1700 DGT F A 6 FT #HET 186 186 ASN F 3 1700 DGT F A 6 FT #HET 187 187 MET F 3 1700 DGT F A 6 FT #HET 190 190 ILE F 3 1700 DGT F S 1 FT #HET 202 202 LYS F 1 1700 DGT E A 4 FT #HET 214 214 LEU F 3 1700 DGT F S 1 FT #HET 215 215 ARG F 3 1700 DGT F S 13 FT #HET 221 221 ILE F 3 1700 DGT F A 8 FT #HET 222 222 LYS F 3 1700 DGT F A 7 FT #HET 229 229 SER F 3 1700 DGT F S 1 FT #HET 244 244 TYR F 1 1700 DGT E A 12 FT #HET 245 245 ALA F 1 1700 DGT E B 1 FT #HET 246 246 ASN F 1 1700 DGT E B 1 FT DISORDER 1 10 FT DISORDER 247 251 FT DISORDER 701 714 CC Miss-BB 2 CC Miss-SC 2 CC SEQUENCE 685 AA (ATOM); CC QETMDYHALN AMLNLYDKAG HIQFDKDQQA IDAFFATHVR PHSVTFASQH ERLGTLVREG CC YYDDAVLARY DRAFVLRLFE HAHASGFRFQ TFLGAWKFYT SYTLKTFDGK RYLEHFEDRV CC TMVALTLAQG DETLATQLTD EMLSGRFQPA TPTFLNCGKQ QRGELVSCFL LRIEDNMESI CC GRAVNSALQL SKRGGGVAFL LSNLREAGAP IKRIENQSSG VIPVMKMLED AFSYANQGAG CC AVYLHAHHPD ILRFLDTKRE NADEKIRIKT LSLGVVIPDI TFRLAKENAQ MALFSPYDIQ CC RRYGKPFGDI AISERYDELI ADPHVRKTYI NARDFFQTLA EIQFESGYPY IMFEDTVNRA CC NPIAGRINMS NLCSEILQVN SASRYDDNLD YTHIGHDISC NLGSLNIAHV MDSPDIGRTV CC ETAIRGLTAV SDMSHIRSVP SIAAGNAASH AIGLGQMNLH GYLAREGIAY GSPEALDFTN CC LYFYTITWHA VHTSMRLARE RGKTFAGFAQ SRYASGDYFT QYLQDDWQPK TAKVRALFAR CC SGITLPTREM WLKLRDDVMR YGIYNQNLQA VPPTGSISYI NHATSSIHPI VAKIEIRKEG CC KTGRVYYPAP FMTNENLDMY QDAYDIGPEK IIDTYAEATR HVDQGLSLTL FFPDTATTRD CC INKAQIYAWR KGIKSLYYIR LRQLA CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MATTTPERVMQETMDYHALNAMLNLYDKAGHIQFDKDQQAIDAFFATHVR CC ATOM ----------QETMDYHALNAMLNLYDKAGHIQFDKDQQAIDAFFATHVR CC **************************************** CC SEQRES PHSVTFASQHERLGTLVREGYYDDAVLARYDRAFVLRLFEHAHASGFRFQ CC ATOM PHSVTFASQHERLGTLVREGYYDDAVLARYDRAFVLRLFEHAHASGFRFQ CC ************************************************** CC SEQRES TFLGAWKFYTSYTLKTFDGKRYLEHFEDRVTMVALTLAQGDETLATQLTD CC ATOM TFLGAWKFYTSYTLKTFDGKRYLEHFEDRVTMVALTLAQGDETLATQLTD CC ************************************************** CC SEQRES EMLSGRFQPATPTFLNCGKQQRGELVSCFLLRIEDNMESIGRAVNSALQL CC ATOM EMLSGRFQPATPTFLNCGKQQRGELVSCFLLRIEDNMESIGRAVNSALQL CC ************************************************** CC SEQRES SKRGGGVAFLLSNLREAGAPIKRIENQSSGVIPVMKMLEDAFSYANQLGA CC ATOM SKRGGGVAFLLSNLREAGAPIKRIENQSSGVIPVMKMLEDAFSYAN---- CC ********************************************** CC SEQRES RQGAGAVYLHAHHPDILRFLDTKRENADEKIRIKTLSLGVVIPDITFRLA CC ATOM -QGAGAVYLHAHHPDILRFLDTKRENADEKIRIKTLSLGVVIPDITFRLA CC ************************************************* CC SEQRES KENAQMALFSPYDIQRRYGKPFGDIAISERYDELIADPHVRKTYINARDF CC ATOM KENAQMALFSPYDIQRRYGKPFGDIAISERYDELIADPHVRKTYINARDF CC ************************************************** CC SEQRES FQTLAEIQFESGYPYIMFEDTVNRANPIAGRINMSNLCSEILQVNSASRY CC ATOM FQTLAEIQFESGYPYIMFEDTVNRANPIAGRINMSNLCSEILQVNSASRY CC ************************************************** CC SEQRES DDNLDYTHIGHDISCNLGSLNIAHVMDSPDIGRTVETAIRGLTAVSDMSH CC ATOM DDNLDYTHIGHDISCNLGSLNIAHVMDSPDIGRTVETAIRGLTAVSDMSH CC ************************************************** CC SEQRES IRSVPSIAAGNAASHAIGLGQMNLHGYLAREGIAYGSPEALDFTNLYFYT CC ATOM IRSVPSIAAGNAASHAIGLGQMNLHGYLAREGIAYGSPEALDFTNLYFYT CC ************************************************** CC SEQRES ITWHAVHTSMRLARERGKTFAGFAQSRYASGDYFTQYLQDDWQPKTAKVR CC ATOM ITWHAVHTSMRLARERGKTFAGFAQSRYASGDYFTQYLQDDWQPKTAKVR CC ************************************************** CC SEQRES ALFARSGITLPTREMWLKLRDDVMRYGIYNQNLQAVPPTGSISYINHATS CC ATOM ALFARSGITLPTREMWLKLRDDVMRYGIYNQNLQAVPPTGSISYINHATS CC ************************************************** CC SEQRES SIHPIVAKIEIRKEGKTGRVYYPAPFMTNENLDMYQDAYDIGPEKIIDTY CC ATOM SIHPIVAKIEIRKEGKTGRVYYPAPFMTNENLDMYQDAYDIGPEKIIDTY CC ************************************************** CC SEQRES AEATRHVDQGLSLTLFFPDTATTRDINKAQIYAWRKGIKSLYYIRLRQLA CC ATOM AEATRHVDQGLSLTLFFPDTATTRDINKAQIYAWRKGIKSLYYIRLRQLA CC ************************************************** CC SEQRES LEGTEIEGCVSCAL CC ATOM -------------- CC SQ SEQUENCE 714 AA; MW; CN; MATTTPERVM QETMDYHALN AMLNLYDKAG HIQFDKDQQA IDAFFATHVR PHSVTFASQH ERLGTLVREG YYDDAVLARY DRAFVLRLFE HAHASGFRFQ TFLGAWKFYT SYTLKTFDGK RYLEHFEDRV TMVALTLAQG DETLATQLTD EMLSGRFQPA TPTFLNCGKQ QRGELVSCFL LRIEDNMESI GRAVNSALQL SKRGGGVAFL LSNLREAGAP IKRIENQSSG VIPVMKMLED AFSYANQLGA RQGAGAVYLH AHHPDILRFL DTKRENADEK IRIKTLSLGV VIPDITFRLA KENAQMALFS PYDIQRRYGK PFGDIAISER YDELIADPHV RKTYINARDF FQTLAEIQFE SGYPYIMFED TVNRANPIAG RINMSNLCSE ILQVNSASRY DDNLDYTHIG HDISCNLGSL NIAHVMDSPD IGRTVETAIR GLTAVSDMSH IRSVPSIAAG NAASHAIGLG QMNLHGYLAR EGIAYGSPEA LDFTNLYFYT ITWHAVHTSM RLARERGKTF AGFAQSRYAS GDYFTQYLQD DWQPKTAKVR ALFARSGITL PTREMWLKLR DDVMRYGIYN QNLQAVPPTG SISYINHATS SIHPIVAKIE IRKEGKTGRV YYPAPFMTNE NLDMYQDAYD IGPEKIIDTY AEATRHVDQG LSLTLFFPDT ATTRDINKAQ IYAWRKGIKS LYYIRLRQLA LEGTEIEGCV SCAL // ID 2BQ1I STANDARD; PRT; 319 AA. DT CONVERTED FROM PDB (SEQRES) 2BQ1 DE RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE 2 BETA SUBUNIT OS SALMONELLA TYPHIMURIUM CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.990 CC R-Factor 0.265 FT #SUB 40 40 ASN I 616 616 LYS E Protein B 1 FT #SUB 40 40 ASN I 617 617 THR E Protein A 6 FT #SUB 40 40 ASN I 618 618 GLY E Protein S 1 FT #SUB 43 43 PRO I 616 616 LYS E Protein S 5 FT #SUB 47 47 THR I 13 13 THR E Protein B 1 FT #SUB 174 174 SER I 22 22 MET E Protein B 1 FT #SUB 175 175 ARG I 14 14 MET E Protein A 2 FT #SUB 175 175 ARG I 18 18 ALA E Protein B 5 FT #SUB 175 175 ARG I 22 22 MET E Protein A 4 FT #SUB 176 176 GLY I 18 18 ALA E Protein B 5 FT #SUB 176 176 GLY I 21 21 ALA E Protein B 2 FT #SUB 177 177 LYS I 13 13 THR E Protein S 3 FT #SUB 177 177 LYS I 15 15 ASP E Protein S 1 FT #SUB 177 177 LYS I 18 18 ALA E Protein S 1 FT #SUB 180 180 ASN I 619 619 ARG E Protein S 2 FT #SUB 309 309 THR I 672 672 THR E Protein B 5 FT #SUB 309 309 THR I 673 673 THR E Protein A 4 FT #SUB 310 310 VAL I 352 352 GLN E Protein B 3 FT #SUB 310 310 VAL I 672 672 THR E Protein S 4 FT #SUB 310 310 VAL I 673 673 THR E Protein A 9 FT #SUB 310 310 VAL I 674 674 ARG E Protein S 3 FT #SUB 311 311 GLU I 352 352 GLN E Protein B 4 FT #SUB 311 311 GLU I 673 673 THR E Protein B 2 FT #SUB 311 311 GLU I 674 674 ARG E Protein B 5 FT #SUB 312 312 THR I 348 348 ARG E Protein S 3 FT #SUB 312 312 THR I 352 352 GLN E Protein S 1 FT #SUB 312 312 THR I 674 674 ARG E Protein B 3 FT #SUB 312 312 THR I 677 677 ASN E Protein S 1 FT #SUB 313 313 GLU I 348 348 ARG E Protein B 1 FT #SUB 313 313 GLU I 674 674 ARG E Protein A 5 FT #SUB 314 314 ASP I 348 348 ARG E Protein A 3 FT #SUB 316 316 ASP I 674 674 ARG E Protein A 5 FT #SUB 316 316 ASP I 681 681 ILE E Protein B 1 FT #SUB 317 317 TRP I 300 300 ALA E Protein S 11 FT #SUB 317 317 TRP I 348 348 ARG E Protein S 10 FT #SUB 317 317 TRP I 351 351 PHE E Protein S 2 FT #SUB 317 317 TRP I 681 681 ILE E Protein S 4 FT #SUB 318 318 ASN I 301 301 LYS E Protein B 2 FT #SUB 319 319 PHE I 301 301 LYS E Protein B 2 FT #SUB 319 319 PHE I 681 681 ILE E Protein S 1 FT #SUB 319 319 PHE I 685 685 ARG E Protein S 22 FT #SUB 6 6 ILE I 69 69 ILE J Protein S 1 FT #SUB 6 6 ILE I 139 139 LEU J Protein S 1 FT #SUB 7 7 SER I 126 126 GLU J Protein S 3 FT #SUB 8 8 ALA I 65 65 LEU J Protein A 6 FT #SUB 8 8 ALA I 68 68 THR J Protein B 1 FT #SUB 8 8 ALA I 122 122 TYR J Protein A 2 FT #SUB 9 9 ILE I 64 64 THR J Protein B 1 FT #SUB 9 9 ILE I 68 68 THR J Protein A 2 FT #SUB 9 9 ILE I 102 102 ALA J Protein S 1 FT #SUB 9 9 ILE I 106 106 SER J Protein B 2 FT #SUB 9 9 ILE I 122 122 TYR J Protein B 3 FT #SUB 10 10 ASN I 106 106 SER J Protein A 4 FT #SUB 10 10 ASN I 118 118 VAL J Protein S 1 FT #SUB 10 10 ASN I 122 122 TYR J Protein A 8 FT #SUB 11 11 TRP I 103 103 ARG J Protein S 9 FT #SUB 11 11 TRP I 106 106 SER J Protein A 4 FT #SUB 12 12 ASN I 106 106 SER J Protein S 7 FT #SUB 12 12 ASN I 110 110 SER J Protein S 2 FT #SUB 13 13 LYS I 119 119 ASP J Protein S 1 FT #SUB 23 23 TRP I 96 96 PHE J Protein S 1 FT #SUB 23 23 TRP I 100 100 VAL J Protein S 3 FT #SUB 24 24 ASN I 34 34 GLU J Protein S 1 FT #SUB 30 30 PHE I 30 30 PHE J Protein S 18 FT #SUB 32 32 LEU I 27 27 THR J Protein S 1 FT #SUB 64 64 THR I 8 8 ALA J Protein S 2 FT #SUB 64 64 THR I 9 9 ILE J Protein S 1 FT #SUB 65 65 LEU I 6 6 ILE J Protein S 1 FT #SUB 65 65 LEU I 8 8 ALA J Protein B 2 FT #SUB 68 68 THR I 8 8 ALA J Protein S 2 FT #SUB 68 68 THR I 9 9 ILE J Protein S 2 FT #SUB 71 71 ASN I 92 92 SER J Protein S 1 FT #SUB 72 72 ILE I 88 88 GLU J Protein S 1 FT #SUB 92 92 SER I 71 71 ASN J Protein S 2 FT #SUB 92 92 SER I 95 95 SER J Protein S 1 FT #SUB 92 92 SER I 96 96 PHE J Protein B 2 FT #SUB 93 93 ASN I 96 96 PHE J Protein A 4 FT #SUB 95 95 SER I 92 92 SER J Protein S 1 FT #SUB 96 96 PHE I 92 92 SER J Protein S 1 FT #SUB 96 96 PHE I 93 93 ASN J Protein S 6 FT #SUB 96 96 PHE I 96 96 PHE J Protein S 1 FT #SUB 102 102 ALA I 9 9 ILE J Protein A 2 FT #SUB 103 103 ARG I 11 11 TRP J Protein A 7 FT #SUB 103 103 ARG I 20 20 LEU J Protein S 1 FT #SUB 103 103 ARG I 23 23 TRP J Protein S 2 FT #SUB 106 106 SER I 9 9 ILE J Protein S 1 FT #SUB 106 106 SER I 11 11 TRP J Protein S 4 FT #SUB 106 106 SER I 12 12 ASN J Protein B 6 FT #SUB 109 109 PHE I 12 12 ASN J Protein A 2 FT #SUB 110 110 SER I 12 12 ASN J Protein A 5 FT #SUB 115 115 THR I 13 13 LYS J Protein S 1 FT #SUB 119 119 ASP I 13 13 LYS J Protein S 3 FT #SUB 122 122 TYR I 8 8 ALA J Protein S 1 FT #SUB 122 122 TYR I 9 9 ILE J Protein S 3 FT #SUB 122 122 TYR I 10 10 ASN J Protein S 13 FT #SUB 126 126 GLU I 7 7 SER J Protein S 3 FT #SUB 132 132 GLN I 6 6 ILE J Protein S 1 FT #HET 67 67 ASP I 5 1320 FE I S 3 FT #HET 98 98 GLU I 5 1320 FE I S 3 FT #HET 98 98 GLU I 6 1321 FE I S 3 FT #HET 101 101 HIS I 5 1320 FE I S 4 FT #HET 158 158 GLU I 6 1321 FE I S 4 FT #HET 162 162 PHE I 5 1320 FE I S 2 FT #HET 192 192 GLU I 5 1320 FE I S 4 FT #HET 192 192 GLU I 6 1321 FE I S 3 FT #HET 195 195 HIS I 6 1321 FE I S 4 FT DISORDER 1 5 FT DISORDER 289 308 CC Miss-BB 1 CC Miss-SC 1 CC SEQUENCE 294 AA (ATOM); CC ISAINWNKIQ DDKDLEVWNR LTSNFWLPEK VPLSNDIPAW QTLSAAEQQL TIRVFTGLTL CC LDTIQNIAGA PSLMADAITP HEEAVLSNIS FMEAVHARSY SSIFSTLCQT KEVDAAYAWS CC EENPPLQRKA QIILAHYVSD EPLKKKIASV FLESFLFYSG FWLPMYFSSR GKLTNTADLI CC RLIIRDEAVH GYYIGYKYQI ALQKLSAIER EELKLFALDL LMELYDNEIR YTEALYAETG CC WVNDVKAFLC YNANKALMNL GYEALFPPEM ADVNPAILAA LSPTVETEDE DWNF CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKLSRISAINWNKIQDDKDLEVWNRLTSNFWLPEKVPLSNDIPAWQTLSA CC ATOM -----ISAINWNKIQDDKDLEVWNRLTSNFWLPEKVPLSNDIPAWQTLSA CC ********************************************* CC SEQRES AEQQLTIRVFTGLTLLDTIQNIAGAPSLMADAITPHEEAVLSNISFMEAV CC ATOM AEQQLTIRVFTGLTLLDTIQNIAGAPSLMADAITPHEEAVLSNISFMEAV CC ************************************************** CC SEQRES HARSYSSIFSTLCQTKEVDAAYAWSEENPPLQRKAQIILAHYVSDEPLKK CC ATOM HARSYSSIFSTLCQTKEVDAAYAWSEENPPLQRKAQIILAHYVSDEPLKK CC ************************************************** CC SEQRES KIASVFLESFLFYSGFWLPMYFSSRGKLTNTADLIRLIIRDEAVHGYYIG CC ATOM KIASVFLESFLFYSGFWLPMYFSSRGKLTNTADLIRLIIRDEAVHGYYIG CC ************************************************** CC SEQRES YKYQIALQKLSAIEREELKLFALDLLMELYDNEIRYTEALYAETGWVNDV CC ATOM YKYQIALQKLSAIEREELKLFALDLLMELYDNEIRYTEALYAETGWVNDV CC ************************************************** CC SEQRES KAFLCYNANKALMNLGYEALFPPEMADVNPAILAALSPNADENHDFFSGS CC ATOM KAFLCYNANKALMNLGYEALFPPEMADVNPAILAALSP------------ CC ************************************** CC SEQRES GSSYVMGKTVETEDEDWNF CC ATOM --------TVETEDEDWNF CC *********** SQ SEQUENCE 319 AA; MW; CN; MKLSRISAIN WNKIQDDKDL EVWNRLTSNF WLPEKVPLSN DIPAWQTLSA AEQQLTIRVF TGLTLLDTIQ NIAGAPSLMA DAITPHEEAV LSNISFMEAV HARSYSSIFS TLCQTKEVDA AYAWSEENPP LQRKAQIILA HYVSDEPLKK KIASVFLESF LFYSGFWLPM YFSSRGKLTN TADLIRLIIR DEAVHGYYIG YKYQIALQKL SAIEREELKL FALDLLMELY DNEIRYTEAL YAETGWVNDV KAFLCYNANK ALMNLGYEAL FPPEMADVNP AILAALSPNA DENHDFFSGS GSSYVMGKTV ETEDEDWNF // ID 2BQ1J STANDARD; PRT; 319 AA. DT CONVERTED FROM PDB (SEQRES) 2BQ1 DE RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE 2 BETA SUBUNIT OS SALMONELLA TYPHIMURIUM CC EXPDTA X-RAY DIFFRACTION CC RESOLU 3.990 CC R-Factor 0.265 FT #SUB 6 6 ILE J 65 65 LEU I Protein B 1 FT #SUB 6 6 ILE J 132 132 GLN I Protein B 1 FT #SUB 7 7 SER J 126 126 GLU I Protein A 3 FT #SUB 8 8 ALA J 64 64 THR I Protein S 2 FT #SUB 8 8 ALA J 65 65 LEU I Protein S 2 FT #SUB 8 8 ALA J 68 68 THR I Protein A 2 FT #SUB 8 8 ALA J 122 122 TYR I Protein B 1 FT #SUB 9 9 ILE J 64 64 THR I Protein B 1 FT #SUB 9 9 ILE J 68 68 THR I Protein B 2 FT #SUB 9 9 ILE J 102 102 ALA I Protein S 2 FT #SUB 9 9 ILE J 106 106 SER I Protein B 1 FT #SUB 9 9 ILE J 122 122 TYR I Protein B 3 FT #SUB 10 10 ASN J 122 122 TYR I Protein A 13 FT #SUB 11 11 TRP J 103 103 ARG I Protein A 7 FT #SUB 11 11 TRP J 106 106 SER I Protein A 4 FT #SUB 12 12 ASN J 106 106 SER I Protein S 6 FT #SUB 12 12 ASN J 109 109 PHE I Protein S 2 FT #SUB 12 12 ASN J 110 110 SER I Protein S 5 FT #SUB 13 13 LYS J 115 115 THR I Protein S 1 FT #SUB 13 13 LYS J 119 119 ASP I Protein S 3 FT #SUB 20 20 LEU J 103 103 ARG I Protein S 1 FT #SUB 23 23 TRP J 103 103 ARG I Protein S 2 FT #SUB 27 27 THR J 32 32 LEU I Protein B 1 FT #SUB 30 30 PHE J 30 30 PHE I Protein S 18 FT #SUB 34 34 GLU J 24 24 ASN I Protein S 1 FT #SUB 64 64 THR J 9 9 ILE I Protein S 1 FT #SUB 65 65 LEU J 8 8 ALA I Protein A 6 FT #SUB 68 68 THR J 8 8 ALA I Protein S 1 FT #SUB 68 68 THR J 9 9 ILE I Protein S 2 FT #SUB 69 69 ILE J 6 6 ILE I Protein S 1 FT #SUB 71 71 ASN J 92 92 SER I Protein S 2 FT #SUB 88 88 GLU J 72 72 ILE I Protein S 1 FT #SUB 92 92 SER J 71 71 ASN I Protein S 1 FT #SUB 92 92 SER J 95 95 SER I Protein S 1 FT #SUB 92 92 SER J 96 96 PHE I Protein B 1 FT #SUB 93 93 ASN J 96 96 PHE I Protein A 6 FT #SUB 95 95 SER J 92 92 SER I Protein S 1 FT #SUB 96 96 PHE J 23 23 TRP I Protein S 1 FT #SUB 96 96 PHE J 92 92 SER I Protein S 2 FT #SUB 96 96 PHE J 93 93 ASN I Protein S 4 FT #SUB 96 96 PHE J 96 96 PHE I Protein S 1 FT #SUB 100 100 VAL J 23 23 TRP I Protein S 3 FT #SUB 102 102 ALA J 9 9 ILE I Protein S 1 FT #SUB 103 103 ARG J 11 11 TRP I Protein A 9 FT #SUB 106 106 SER J 9 9 ILE I Protein S 2 FT #SUB 106 106 SER J 10 10 ASN I Protein S 4 FT #SUB 106 106 SER J 11 11 TRP I Protein S 4 FT #SUB 106 106 SER J 12 12 ASN I Protein A 7 FT #SUB 110 110 SER J 12 12 ASN I Protein S 2 FT #SUB 118 118 VAL J 10 10 ASN I Protein S 1 FT #SUB 119 119 ASP J 13 13 LYS I Protein S 1 FT #SUB 122 122 TYR J 8 8 ALA I Protein S 2 FT #SUB 122 122 TYR J 9 9 ILE I Protein S 3 FT #SUB 122 122 TYR J 10 10 ASN I Protein S 8 FT #SUB 126 126 GLU J 7 7 SER I Protein S 3 FT #SUB 139 139 LEU J 6 6 ILE I Protein S 1 FT #HET 67 67 ASP J 7 1287 FE J S 3 FT #HET 70 70 GLN J 8 1288 FE J S 1 FT #HET 98 98 GLU J 7 1287 FE J A 6 FT #HET 98 98 GLU J 8 1288 FE J S 4 FT #HET 101 101 HIS J 7 1287 FE J S 4 FT #HET 158 158 GLU J 8 1288 FE J S 3 FT #HET 192 192 GLU J 7 1287 FE J S 3 FT #HET 192 192 GLU J 8 1288 FE J S 2 FT #HET 195 195 HIS J 8 1288 FE J S 4 FT DISORDER 1 5 FT DISORDER 287 319 CC SEQUENCE 281 AA (ATOM); CC ISAINWNKIQ DDKDLEVWNR LTSNFWLPEK VPLSNDIPAW QTLSAAEQQL TIRVFTGLTL CC LDTIQNIAGA PSLMADAITP HEEAVLSNIS FMEAVHARSY SSIFSTLCQT KEVDAAYAWS CC EENPPLQRKA QIILAHYVSD EPLKKKIASV FLESFLFYSG FWLPMYFSSR GKLTNTADLI CC RLIIRDEAVH GYYIGYKYQI ALQKLSAIER EELKLFALDL LMELYDNEIR YTEALYAETG CC WVNDVKAFLC YNANKALMNL GYEALFPPEM ADVNPAILAA L CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKLSRISAINWNKIQDDKDLEVWNRLTSNFWLPEKVPLSNDIPAWQTLSA CC ATOM -----ISAINWNKIQDDKDLEVWNRLTSNFWLPEKVPLSNDIPAWQTLSA CC ********************************************* CC SEQRES AEQQLTIRVFTGLTLLDTIQNIAGAPSLMADAITPHEEAVLSNISFMEAV CC ATOM AEQQLTIRVFTGLTLLDTIQNIAGAPSLMADAITPHEEAVLSNISFMEAV CC ************************************************** CC SEQRES HARSYSSIFSTLCQTKEVDAAYAWSEENPPLQRKAQIILAHYVSDEPLKK CC ATOM HARSYSSIFSTLCQTKEVDAAYAWSEENPPLQRKAQIILAHYVSDEPLKK CC ************************************************** CC SEQRES KIASVFLESFLFYSGFWLPMYFSSRGKLTNTADLIRLIIRDEAVHGYYIG CC ATOM KIASVFLESFLFYSGFWLPMYFSSRGKLTNTADLIRLIIRDEAVHGYYIG CC ************************************************** CC SEQRES YKYQIALQKLSAIEREELKLFALDLLMELYDNEIRYTEALYAETGWVNDV CC ATOM YKYQIALQKLSAIEREELKLFALDLLMELYDNEIRYTEALYAETGWVNDV CC ************************************************** CC SEQRES KAFLCYNANKALMNLGYEALFPPEMADVNPAILAALSPNADENHDFFSGS CC ATOM KAFLCYNANKALMNLGYEALFPPEMADVNPAILAAL-------------- CC ************************************ CC SEQRES GSSYVMGKTVETEDEDWNF CC ATOM ------------------- CC SQ SEQUENCE 319 AA; MW; CN; MKLSRISAIN WNKIQDDKDL EVWNRLTSNF WLPEKVPLSN DIPAWQTLSA AEQQLTIRVF TGLTLLDTIQ NIAGAPSLMA DAITPHEEAV LSNISFMEAV HARSYSSIFS TLCQTKEVDA AYAWSEENPP LQRKAQIILA HYVSDEPLKK KIASVFLESF LFYSGFWLPM YFSSRGKLTN TADLIRLIIR DEAVHGYYIG YKYQIALQKL SAIEREELKL FALDLLMELY DNEIRYTEAL YAETGWVNDV KAFLCYNANK ALMNLGYEAL FPPEMADVNP AILAALSPNA DENHDFFSGS GSSYVMGKTV ETEDEDWNF //