ID 5ZRNA STANDARD; PRT; 398 AA. DT CONVERTED FROM PDB (SEQRES) 5ZRN DE Long-chain-fatty-acid--CoA ligase FadD13 OS Mycobacterium tuberculosis CDC1551 CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.370 CC R-Factor 0.198 FT #SUB 87 87 ARG A 87 87 ARG B Protein A 11 FT #SUB 87 87 ARG A 89 89 ALA B Protein S 1 FT #SUB 87 87 ARG A 92 92 GLU B Protein S 3 FT #SUB 89 89 ALA A 87 87 ARG B Protein S 1 FT #SUB 89 89 ALA A 230 230 GLN B Protein S 2 FT #SUB 91 91 PRO A 230 230 GLN B Protein S 1 FT #SUB 91 91 PRO A 231 231 PHE B Protein S 2 FT #SUB 110 110 PRO A 113 113 PRO B Protein B 2 FT #SUB 113 113 PRO A 110 110 PRO B Protein S 3 FT #SUB 167 167 THR A 253 253 ALA B Protein S 3 FT #SUB 169 169 GLY A 253 253 ALA B Protein B 1 FT #SUB 169 169 GLY A 256 256 ASN B Protein B 3 FT #SUB 169 169 GLY A 257 257 PHE B Protein B 1 FT #SUB 169 169 GLY A 260 260 GLN B Protein B 3 FT #SUB 170 170 HIS A 256 256 ASN B Protein S 1 FT #SUB 170 170 HIS A 259 259 ARG B Protein S 2 FT #SUB 170 170 HIS A 260 260 GLN B Protein S 7 FT #SUB 171 171 PRO A 257 257 PHE B Protein S 1 FT #SUB 230 230 GLN A 91 91 PRO B Protein S 3 FT #SUB 231 231 PHE A 91 91 PRO B Protein B 2 FT #SUB 232 232 ASP A 91 91 PRO B Protein S 1 FT #SUB 253 253 ALA A 167 167 THR B Protein A 3 FT #SUB 253 253 ALA A 168 168 THR B Protein S 2 FT #SUB 253 253 ALA A 169 169 GLY B Protein A 4 FT #SUB 257 257 PHE A 169 169 GLY B Protein A 9 FT #SUB 257 257 PHE A 171 171 PRO B Protein S 2 FT #SUB 260 260 GLN A 169 169 GLY B Protein S 3 FT #SUB 260 260 GLN A 170 170 HIS B Protein S 7 FT #HET 165 165 SER A 1 2001 JSA A S 1 FT #HET 188 188 TRP A 1 2001 JSA A A 17 FT #HET 208 208 HIS A 1 2001 JSA A S 3 FT #HET 209 209 VAL A 1 2001 JSA A S 1 FT #HET 278 278 GLY A 1 2001 JSA A B 3 FT #HET 279 279 GLY A 1 2001 JSA A B 11 FT #HET 280 280 ALA A 1 2001 JSA A B 3 FT #HET 300 300 GLY A 1 2001 JSA A B 4 FT #HET 301 301 TYR A 1 2001 JSA A A 9 FT #HET 302 302 ALA A 1 2001 JSA A A 12 FT #HET 303 303 LEU A 1 2001 JSA A A 13 FT #HET 304 304 THR A 1 2001 JSA A A 4 FT #HET 308 308 GLY A 1 2001 JSA A B 3 FT #HET 329 329 THR A 1 2001 JSA A S 1 FT #HET 382 382 ASP A 1 2001 JSA A S 10 FT #HET 394 394 ILE A 1 2001 JSA A S 1 CC SEQUENCE 398 AA (ATOM); CC MKNIGWMLRQ RATVSPRLQA YVEPSTDVRM TYAQMNALAN RCADVLTALG IAKGDRVALL CC MPNSVEFCCL FYGAAKLGAV AVPINTRLAA PEVSFILSDS GSKVVIYGAP SAPVIDAIRA CC QADPPGTVTD WIGADSLAER LRSAAADEPA VECGGDDNLF IMYTSGTTGH PKGVVHTHES CC VHSAASSWAS TIDVRYRDRL LLPLPMFHVA ALTTVIFSAM RGVTLISMPQ FDATKVWSLI CC VEERVCIGGA VPAILNFMRQ VPEFAELDAP DFRYFITGGA PMPEALIKIY AAKNIEVVQG CC YALTESCGGG TLLLSEDALR KAGSAGRATM FTDVAVRGDD GVIREHGEGE VVIKSDILLK CC EYWNRPEATR DAFDNGWFRT GDIGEIDDEG YLYIKDRL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKNIGWMLRQRATVSPRLQAYVEPSTDVRMTYAQMNALANRCADVLTALG CC ATOM MKNIGWMLRQRATVSPRLQAYVEPSTDVRMTYAQMNALANRCADVLTALG CC ************************************************** CC SEQRES IAKGDRVALLMPNSVEFCCLFYGAAKLGAVAVPINTRLAAPEVSFILSDS CC ATOM IAKGDRVALLMPNSVEFCCLFYGAAKLGAVAVPINTRLAAPEVSFILSDS CC ************************************************** CC SEQRES GSKVVIYGAPSAPVIDAIRAQADPPGTVTDWIGADSLAERLRSAAADEPA CC ATOM GSKVVIYGAPSAPVIDAIRAQADPPGTVTDWIGADSLAERLRSAAADEPA CC ************************************************** CC SEQRES VECGGDDNLFIMYTSGTTGHPKGVVHTHESVHSAASSWASTIDVRYRDRL CC ATOM VECGGDDNLFIMYTSGTTGHPKGVVHTHESVHSAASSWASTIDVRYRDRL CC ************************************************** CC SEQRES LLPLPMFHVAALTTVIFSAMRGVTLISMPQFDATKVWSLIVEERVCIGGA CC ATOM LLPLPMFHVAALTTVIFSAMRGVTLISMPQFDATKVWSLIVEERVCIGGA CC ************************************************** CC SEQRES VPAILNFMRQVPEFAELDAPDFRYFITGGAPMPEALIKIYAAKNIEVVQG CC ATOM VPAILNFMRQVPEFAELDAPDFRYFITGGAPMPEALIKIYAAKNIEVVQG CC ************************************************** CC SEQRES YALTESCGGGTLLLSEDALRKAGSAGRATMFTDVAVRGDDGVIREHGEGE CC ATOM YALTESCGGGTLLLSEDALRKAGSAGRATMFTDVAVRGDDGVIREHGEGE CC ************************************************** CC SEQRES VVIKSDILLKEYWNRPEATRDAFDNGWFRTGDIGEIDDEGYLYIKDRL CC ATOM VVIKSDILLKEYWNRPEATRDAFDNGWFRTGDIGEIDDEGYLYIKDRL CC ************************************************ SQ SEQUENCE 398 AA; MW; CN; MKNIGWMLRQ RATVSPRLQA YVEPSTDVRM TYAQMNALAN RCADVLTALG IAKGDRVALL MPNSVEFCCL FYGAAKLGAV AVPINTRLAA PEVSFILSDS GSKVVIYGAP SAPVIDAIRA QADPPGTVTD WIGADSLAER LRSAAADEPA VECGGDDNLF IMYTSGTTGH PKGVVHTHES VHSAASSWAS TIDVRYRDRL LLPLPMFHVA ALTTVIFSAM RGVTLISMPQ FDATKVWSLI VEERVCIGGA VPAILNFMRQ VPEFAELDAP DFRYFITGGA PMPEALIKIY AAKNIEVVQG YALTESCGGG TLLLSEDALR KAGSAGRATM FTDVAVRGDD GVIREHGEGE VVIKSDILLK EYWNRPEATR DAFDNGWFRT GDIGEIDDEG YLYIKDRL // ID 5ZRNB STANDARD; PRT; 398 AA. DT CONVERTED FROM PDB (SEQRES) 5ZRN DE Long-chain-fatty-acid--CoA ligase FadD13 OS Mycobacterium tuberculosis CDC1551 CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.370 CC R-Factor 0.198 FT #SUB 87 87 ARG B 87 87 ARG A Protein A 11 FT #SUB 87 87 ARG B 89 89 ALA A Protein S 1 FT #SUB 89 89 ALA B 87 87 ARG A Protein B 1 FT #SUB 91 91 PRO B 230 230 GLN A Protein S 3 FT #SUB 91 91 PRO B 231 231 PHE A Protein S 2 FT #SUB 91 91 PRO B 232 232 ASP A Protein S 1 FT #SUB 92 92 GLU B 87 87 ARG A Protein S 3 FT #SUB 110 110 PRO B 113 113 PRO A Protein B 3 FT #SUB 113 113 PRO B 110 110 PRO A Protein S 2 FT #SUB 167 167 THR B 253 253 ALA A Protein B 3 FT #SUB 168 168 THR B 253 253 ALA A Protein B 2 FT #SUB 169 169 GLY B 253 253 ALA A Protein B 4 FT #SUB 169 169 GLY B 257 257 PHE A Protein B 9 FT #SUB 169 169 GLY B 260 260 GLN A Protein B 3 FT #SUB 170 170 HIS B 260 260 GLN A Protein S 7 FT #SUB 171 171 PRO B 257 257 PHE A Protein S 2 FT #SUB 230 230 GLN B 89 89 ALA A Protein S 2 FT #SUB 230 230 GLN B 91 91 PRO A Protein S 1 FT #SUB 231 231 PHE B 91 91 PRO A Protein B 2 FT #SUB 253 253 ALA B 167 167 THR A Protein A 3 FT #SUB 253 253 ALA B 169 169 GLY A Protein B 1 FT #SUB 256 256 ASN B 169 169 GLY A Protein S 3 FT #SUB 256 256 ASN B 170 170 HIS A Protein S 1 FT #SUB 257 257 PHE B 169 169 GLY A Protein B 1 FT #SUB 257 257 PHE B 171 171 PRO A Protein S 1 FT #SUB 259 259 ARG B 170 170 HIS A Protein S 2 FT #SUB 260 260 GLN B 169 169 GLY A Protein S 3 FT #SUB 260 260 GLN B 170 170 HIS A Protein S 7 FT #HET 188 188 TRP B 2 401 JSA B S 14 FT #HET 208 208 HIS B 2 401 JSA B S 4 FT #HET 209 209 VAL B 2 401 JSA B S 1 FT #HET 279 279 GLY B 2 401 JSA B B 7 FT #HET 300 300 GLY B 2 401 JSA B B 6 FT #HET 301 301 TYR B 2 401 JSA B A 12 FT #HET 302 302 ALA B 2 401 JSA B A 15 FT #HET 303 303 LEU B 2 401 JSA B A 10 FT #HET 304 304 THR B 2 401 JSA B A 8 FT #HET 308 308 GLY B 2 401 JSA B B 2 FT #HET 329 329 THR B 2 401 JSA B S 1 FT #HET 382 382 ASP B 2 401 JSA B S 12 FT #HET 394 394 ILE B 2 401 JSA B S 1 FT #HET 397 397 ARG B 2 401 JSA B S 1 CC SEQUENCE 398 AA (ATOM); CC MKNIGWMLRQ RATVSPRLQA YVEPSTDVRM TYAQMNALAN RCADVLTALG IAKGDRVALL CC MPNSVEFCCL FYGAAKLGAV AVPINTRLAA PEVSFILSDS GSKVVIYGAP SAPVIDAIRA CC QADPPGTVTD WIGADSLAER LRSAAADEPA VECGGDDNLF IMYTSGTTGH PKGVVHTHES CC VHSAASSWAS TIDVRYRDRL LLPLPMFHVA ALTTVIFSAM RGVTLISMPQ FDATKVWSLI CC VEERVCIGGA VPAILNFMRQ VPEFAELDAP DFRYFITGGA PMPEALIKIY AAKNIEVVQG CC YALTESCGGG TLLLSEDALR KAGSAGRATM FTDVAVRGDD GVIREHGEGE VVIKSDILLK CC EYWNRPEATR DAFDNGWFRT GDIGEIDDEG YLYIKDRL CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES MKNIGWMLRQRATVSPRLQAYVEPSTDVRMTYAQMNALANRCADVLTALG CC ATOM MKNIGWMLRQRATVSPRLQAYVEPSTDVRMTYAQMNALANRCADVLTALG CC ************************************************** CC SEQRES IAKGDRVALLMPNSVEFCCLFYGAAKLGAVAVPINTRLAAPEVSFILSDS CC ATOM IAKGDRVALLMPNSVEFCCLFYGAAKLGAVAVPINTRLAAPEVSFILSDS CC ************************************************** CC SEQRES GSKVVIYGAPSAPVIDAIRAQADPPGTVTDWIGADSLAERLRSAAADEPA CC ATOM GSKVVIYGAPSAPVIDAIRAQADPPGTVTDWIGADSLAERLRSAAADEPA CC ************************************************** CC SEQRES VECGGDDNLFIMYTSGTTGHPKGVVHTHESVHSAASSWASTIDVRYRDRL CC ATOM VECGGDDNLFIMYTSGTTGHPKGVVHTHESVHSAASSWASTIDVRYRDRL CC ************************************************** CC SEQRES LLPLPMFHVAALTTVIFSAMRGVTLISMPQFDATKVWSLIVEERVCIGGA CC ATOM LLPLPMFHVAALTTVIFSAMRGVTLISMPQFDATKVWSLIVEERVCIGGA CC ************************************************** CC SEQRES VPAILNFMRQVPEFAELDAPDFRYFITGGAPMPEALIKIYAAKNIEVVQG CC ATOM VPAILNFMRQVPEFAELDAPDFRYFITGGAPMPEALIKIYAAKNIEVVQG CC ************************************************** CC SEQRES YALTESCGGGTLLLSEDALRKAGSAGRATMFTDVAVRGDDGVIREHGEGE CC ATOM YALTESCGGGTLLLSEDALRKAGSAGRATMFTDVAVRGDDGVIREHGEGE CC ************************************************** CC SEQRES VVIKSDILLKEYWNRPEATRDAFDNGWFRTGDIGEIDDEGYLYIKDRL CC ATOM VVIKSDILLKEYWNRPEATRDAFDNGWFRTGDIGEIDDEGYLYIKDRL CC ************************************************ SQ SEQUENCE 398 AA; MW; CN; MKNIGWMLRQ RATVSPRLQA YVEPSTDVRM TYAQMNALAN RCADVLTALG IAKGDRVALL MPNSVEFCCL FYGAAKLGAV AVPINTRLAA PEVSFILSDS GSKVVIYGAP SAPVIDAIRA QADPPGTVTD WIGADSLAER LRSAAADEPA VECGGDDNLF IMYTSGTTGH PKGVVHTHES VHSAASSWAS TIDVRYRDRL LLPLPMFHVA ALTTVIFSAM RGVTLISMPQ FDATKVWSLI VEERVCIGGA VPAILNFMRQ VPEFAELDAP DFRYFITGGA PMPEALIKIY AAKNIEVVQG YALTESCGGG TLLLSEDALR KAGSAGRATM FTDVAVRGDD GVIREHGEGE VVIKSDILLK EYWNRPEATR DAFDNGWFRT GDIGEIDDEG YLYIKDRL //