ID 1CLEA STANDARD; PRT; 534 AA. DT CONVERTED FROM PDB (SEQRES) 1CLE DE CHOLESTEROL ESTERASE OS Candida cylindracea CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.000 CC R-Factor 0.149 FT #SUB 73 73 LEU A 459 459 LEU B Protein S 2 FT #SUB 86 86 VAL A 86 86 VAL B Protein S 1 FT #SUB 350 350 LEU A 443 443 PRO B Protein S 1 FT #SUB 353 353 THR A 396 396 PHE B Protein S 5 FT #SUB 395 395 ILE A 401 401 PRO B Protein S 1 FT #SUB 396 396 PHE A 353 353 THR B Protein S 5 FT #SUB 396 396 PHE A 399 399 ILE B Protein A 3 FT #SUB 396 396 PHE A 401 401 PRO B Protein S 4 FT #SUB 397 397 ASN A 398 398 ALA B Protein B 1 FT #SUB 397 397 ASN A 399 399 ILE B Protein A 5 FT #SUB 398 398 ALA A 397 397 ASN B Protein B 1 FT #SUB 398 398 ALA A 398 398 ALA B Protein B 6 FT #SUB 399 399 ILE A 396 396 PHE B Protein B 4 FT #SUB 399 399 ILE A 397 397 ASN B Protein B 4 FT #SUB 399 399 ILE A 444 444 ILE B Protein S 2 FT #SUB 400 400 THR A 396 396 PHE B Protein S 2 FT #SUB 401 401 PRO A 396 396 PHE B Protein S 2 FT #SUB 443 443 PRO A 350 350 LEU B Protein S 3 FT #SUB 444 444 ILE A 399 399 ILE B Protein S 1 FT #SUB 459 459 LEU A 73 73 LEU B Protein S 1 FT #HET 20 20 ASN A 6 601 PO4 A S 8 FT #HET 22 22 ALA A 6 601 PO4 A S 1 FT #HET 56 56 TYR A 6 601 PO4 A S 1 FT #HET 69 69 PHE A 2 2 NAG C S 2 FT #HET 70 70 GLU A 1 1 NAG C S 6 FT #HET 70 70 GLU A 2 2 NAG C S 9 FT #HET 103 103 VAL A 6 601 PO4 A S 3 FT #HET 122 122 GLY A 7 801 CLL A B 2 FT #HET 123 123 GLY A 7 801 CLL A B 1 FT #HET 124 124 GLY A 7 801 CLL A B 8 FT #HET 127 127 ILE A 7 801 CLL A S 1 FT #HET 132 132 ILE A 7 801 CLL A A 4 FT #HET 133 133 PHE A 7 801 CLL A S 5 FT #HET 208 208 GLU A 7 801 CLL A S 5 FT #HET 209 209 SER A 7 801 CLL A S 6 FT #HET 210 210 ALA A 7 801 CLL A B 2 FT #HET 213 213 MET A 7 801 CLL A S 3 FT #HET 221 221 TRP A 5 535 NAG A S 2 FT #HET 222 222 ASN A 5 535 NAG A S 6 FT #HET 246 246 PRO A 7 801 CLL A S 4 FT #HET 296 296 PHE A 7 801 CLL A S 3 FT #HET 299 299 TYR A 1 1 NAG C S 13 FT #HET 299 299 TYR A 2 2 NAG C S 3 FT #HET 300 300 SER A 2 2 NAG C S 1 FT #HET 300 300 SER A 7 801 CLL A B 1 FT #HET 302 302 LEU A 7 801 CLL A A 12 FT #HET 303 303 ARG A 7 801 CLL A A 3 FT #HET 304 304 LEU A 7 801 CLL A S 3 FT #HET 313 313 LYS A 5 535 NAG A B 2 FT #HET 345 345 PHE A 7 801 CLL A S 2 FT #HET 357 357 GLN A 1 1 NAG C S 3 FT #HET 364 364 GLN A 2 2 NAG C S 1 FT #HET 365 365 SER A 7 801 CLL A S 4 FT #HET 366 366 PHE A 7 801 CLL A S 4 FT #HET 410 410 LEU A 7 801 CLL A S 2 FT #HET 449 449 HIS A 7 801 CLL A S 2 FT #HET 450 450 ALA A 7 801 CLL A S 2 FT #HET 453 453 ILE A 7 801 CLL A S 7 FT #HET 454 454 VAL A 7 801 CLL A S 1 FT #HET 458 458 TYR A 7 801 CLL A S 13 FT #HET 534 534 VAL A 7 801 CLL A S 1 FT #MOD 314 314 ASN A 5 535 NAG A S FT #MOD 351 351 ASN A 1 1 NAG C S CC SEQUENCE 534 AA (ATOM); CC APTAKLANGD TITGLNAIIN EAFLGIPFAE PPVGNLRFKD PVPYSGSLNG QKFTSYGPSC CC MQQNPEGTFE ENLGKTALDL VMQSKVFQAV LPQSEDCLTI NVVRPPGTKA GANLPVMLWI CC FGGGFEIGSP TIFPPAQMVT KSVLMGKPII HVAVNYRVAS WGFLAGDDIK AEGSGNAGLK CC DQRLGMQWVA DNIAGFGGDP SKVTIFGESA GSMSVLCHLI WNDGDNTYKG KPLFRAGIMQ CC SGAMVPSDPV DGTYGNEIYD LFVSSAGCGS ASDKLACLRS ASSDTLLDAT NNTPGFLAYS CC SLRLSYLPRP DGKNITDDMY KLVRDGKYAS VPVIIGDQND EGTVFGLSSL NVTTNAQARA CC YFKQSFIHAS DAEIDTLMAA YPQDITQGSP FDTGIFNAIT PQFKRISAVL GDLAFIHARR CC YFLNHFQGGT KYSFLSKQLS GLPIMGTFHA NDIVWQDYLL GSGSVIYNNA FIAFATDLDP CC NTAGLLVNWP KYTSSSQSGN NLMMINALGL YTGKDNFRTA GYDALMTNPS SFFV CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES APTAKLANGDTITGLNAIINEAFLGIPFAEPPVGNLRFKDPVPYSGSLNG CC ATOM APTAKLANGDTITGLNAIINEAFLGIPFAEPPVGNLRFKDPVPYSGSLNG CC ************************************************** CC SEQRES QKFTSYGPSCMQQNPEGTFEENLGKTALDLVMQSKVFQAVLPQSEDCLTI CC ATOM QKFTSYGPSCMQQNPEGTFEENLGKTALDLVMQSKVFQAVLPQSEDCLTI CC ************************************************** CC SEQRES NVVRPPGTKAGANLPVMLWIFGGGFEIGSPTIFPPAQMVTKSVLMGKPII CC ATOM NVVRPPGTKAGANLPVMLWIFGGGFEIGSPTIFPPAQMVTKSVLMGKPII CC ************************************************** CC SEQRES HVAVNYRVASWGFLAGDDIKAEGSGNAGLKDQRLGMQWVADNIAGFGGDP CC ATOM HVAVNYRVASWGFLAGDDIKAEGSGNAGLKDQRLGMQWVADNIAGFGGDP CC ************************************************** CC SEQRES SKVTIFGESAGSMSVLCHLIWNDGDNTYKGKPLFRAGIMQSGAMVPSDPV CC ATOM SKVTIFGESAGSMSVLCHLIWNDGDNTYKGKPLFRAGIMQSGAMVPSDPV CC ************************************************** CC SEQRES DGTYGNEIYDLFVSSAGCGSASDKLACLRSASSDTLLDATNNTPGFLAYS CC ATOM DGTYGNEIYDLFVSSAGCGSASDKLACLRSASSDTLLDATNNTPGFLAYS CC ************************************************** CC SEQRES SLRLSYLPRPDGKNITDDMYKLVRDGKYASVPVIIGDQNDEGTVFGLSSL CC ATOM SLRLSYLPRPDGKNITDDMYKLVRDGKYASVPVIIGDQNDEGTVFGLSSL CC ************************************************** CC SEQRES NVTTNAQARAYFKQSFIHASDAEIDTLMAAYPQDITQGSPFDTGIFNAIT CC ATOM NVTTNAQARAYFKQSFIHASDAEIDTLMAAYPQDITQGSPFDTGIFNAIT CC ************************************************** CC SEQRES PQFKRISAVLGDLAFIHARRYFLNHFQGGTKYSFLSKQLSGLPIMGTFHA CC ATOM PQFKRISAVLGDLAFIHARRYFLNHFQGGTKYSFLSKQLSGLPIMGTFHA CC ************************************************** CC SEQRES NDIVWQDYLLGSGSVIYNNAFIAFATDLDPNTAGLLVNWPKYTSSSQSGN CC ATOM NDIVWQDYLLGSGSVIYNNAFIAFATDLDPNTAGLLVNWPKYTSSSQSGN CC ************************************************** CC SEQRES NLMMINALGLYTGKDNFRTAGYDALMTNPSSFFV CC ATOM NLMMINALGLYTGKDNFRTAGYDALMTNPSSFFV CC ********************************** SQ SEQUENCE 534 AA; MW; CN; APTAKLANGD TITGLNAIIN EAFLGIPFAE PPVGNLRFKD PVPYSGSLNG QKFTSYGPSC MQQNPEGTFE ENLGKTALDL VMQSKVFQAV LPQSEDCLTI NVVRPPGTKA GANLPVMLWI FGGGFEIGSP TIFPPAQMVT KSVLMGKPII HVAVNYRVAS WGFLAGDDIK AEGSGNAGLK DQRLGMQWVA DNIAGFGGDP SKVTIFGESA GSMSVLCHLI WNDGDNTYKG KPLFRAGIMQ SGAMVPSDPV DGTYGNEIYD LFVSSAGCGS ASDKLACLRS ASSDTLLDAT NNTPGFLAYS SLRLSYLPRP DGKNITDDMY KLVRDGKYAS VPVIIGDQND EGTVFGLSSL NVTTNAQARA YFKQSFIHAS DAEIDTLMAA YPQDITQGSP FDTGIFNAIT PQFKRISAVL GDLAFIHARR YFLNHFQGGT KYSFLSKQLS GLPIMGTFHA NDIVWQDYLL GSGSVIYNNA FIAFATDLDP NTAGLLVNWP KYTSSSQSGN NLMMINALGL YTGKDNFRTA GYDALMTNPS SFFV // ID 1CLEB STANDARD; PRT; 534 AA. DT CONVERTED FROM PDB (SEQRES) 1CLE DE CHOLESTEROL ESTERASE OS Candida cylindracea CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.000 CC R-Factor 0.149 FT #SUB 73 73 LEU B 459 459 LEU A Protein S 1 FT #SUB 86 86 VAL B 86 86 VAL A Protein S 1 FT #SUB 350 350 LEU B 443 443 PRO A Protein S 3 FT #SUB 353 353 THR B 396 396 PHE A Protein S 5 FT #SUB 396 396 PHE B 353 353 THR A Protein S 5 FT #SUB 396 396 PHE B 399 399 ILE A Protein A 4 FT #SUB 396 396 PHE B 400 400 THR A Protein S 2 FT #SUB 396 396 PHE B 401 401 PRO A Protein S 2 FT #SUB 397 397 ASN B 398 398 ALA A Protein B 1 FT #SUB 397 397 ASN B 399 399 ILE A Protein A 4 FT #SUB 398 398 ALA B 397 397 ASN A Protein B 1 FT #SUB 398 398 ALA B 398 398 ALA A Protein A 6 FT #SUB 399 399 ILE B 396 396 PHE A Protein B 3 FT #SUB 399 399 ILE B 397 397 ASN A Protein B 5 FT #SUB 399 399 ILE B 444 444 ILE A Protein S 1 FT #SUB 401 401 PRO B 395 395 ILE A Protein S 1 FT #SUB 401 401 PRO B 396 396 PHE A Protein S 4 FT #SUB 443 443 PRO B 350 350 LEU A Protein S 1 FT #SUB 444 444 ILE B 399 399 ILE A Protein S 2 FT #SUB 459 459 LEU B 73 73 LEU A Protein S 2 FT #HET 20 20 ASN B 9 601 PO4 B S 7 FT #HET 22 22 ALA B 9 601 PO4 B S 1 FT #HET 56 56 TYR B 9 601 PO4 B S 1 FT #HET 69 69 PHE B 4 2 NAG D S 3 FT #HET 70 70 GLU B 3 1 NAG D S 6 FT #HET 70 70 GLU B 4 2 NAG D S 11 FT #HET 122 122 GLY B 10 802 CLL B B 4 FT #HET 123 123 GLY B 10 802 CLL B B 4 FT #HET 124 124 GLY B 10 802 CLL B B 9 FT #HET 132 132 ILE B 10 802 CLL B S 1 FT #HET 208 208 GLU B 10 802 CLL B S 3 FT #HET 209 209 SER B 10 802 CLL B S 2 FT #HET 210 210 ALA B 10 802 CLL B B 1 FT #HET 213 213 MET B 10 802 CLL B S 5 FT #HET 221 221 TRP B 8 535 NAG B S 3 FT #HET 222 222 ASN B 8 535 NAG B S 4 FT #HET 246 246 PRO B 10 802 CLL B S 3 FT #HET 296 296 PHE B 10 802 CLL B S 8 FT #HET 299 299 TYR B 3 1 NAG D S 16 FT #HET 299 299 TYR B 4 2 NAG D S 4 FT #HET 300 300 SER B 4 2 NAG D S 1 FT #HET 300 300 SER B 10 802 CLL B B 1 FT #HET 302 302 LEU B 10 802 CLL B A 10 FT #HET 303 303 ARG B 10 802 CLL B A 4 FT #HET 304 304 LEU B 10 802 CLL B S 3 FT #HET 313 313 LYS B 8 535 NAG B A 6 FT #HET 345 345 PHE B 10 802 CLL B S 3 FT #HET 357 357 GLN B 3 1 NAG D S 3 FT #HET 361 361 TYR B 10 802 CLL B S 2 FT #HET 364 364 GLN B 4 2 NAG D S 1 FT #HET 365 365 SER B 10 802 CLL B S 5 FT #HET 366 366 PHE B 10 802 CLL B S 1 FT #HET 410 410 LEU B 10 802 CLL B S 2 FT #HET 413 413 LEU B 10 802 CLL B S 1 FT #HET 414 414 ALA B 10 802 CLL B S 1 FT #HET 449 449 HIS B 10 802 CLL B S 1 FT #HET 450 450 ALA B 10 802 CLL B A 5 FT #HET 453 453 ILE B 10 802 CLL B S 3 FT #HET 454 454 VAL B 10 802 CLL B S 1 FT #HET 458 458 TYR B 10 802 CLL B S 7 FT #MOD 314 314 ASN B 8 535 NAG B S FT #MOD 351 351 ASN B 3 1 NAG D S CC SEQUENCE 534 AA (ATOM); CC APTAKLANGD TITGLNAIIN EAFLGIPFAE PPVGNLRFKD PVPYSGSLNG QKFTSYGPSC CC MQQNPEGTFE ENLGKTALDL VMQSKVFQAV LPQSEDCLTI NVVRPPGTKA GANLPVMLWI CC FGGGFEIGSP TIFPPAQMVT KSVLMGKPII HVAVNYRVAS WGFLAGDDIK AEGSGNAGLK CC DQRLGMQWVA DNIAGFGGDP SKVTIFGESA GSMSVLCHLI WNDGDNTYKG KPLFRAGIMQ CC SGAMVPSDPV DGTYGNEIYD LFVSSAGCGS ASDKLACLRS ASSDTLLDAT NNTPGFLAYS CC SLRLSYLPRP DGKNITDDMY KLVRDGKYAS VPVIIGDQND EGTVFGLSSL NVTTNAQARA CC YFKQSFIHAS DAEIDTLMAA YPQDITQGSP FDTGIFNAIT PQFKRISAVL GDLAFIHARR CC YFLNHFQGGT KYSFLSKQLS GLPIMGTFHA NDIVWQDYLL GSGSVIYNNA FIAFATDLDP CC NTAGLLVNWP KYTSSSQSGN NLMMINALGL YTGKDNFRTA GYDALMTNPS SFFV CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES APTAKLANGDTITGLNAIINEAFLGIPFAEPPVGNLRFKDPVPYSGSLNG CC ATOM APTAKLANGDTITGLNAIINEAFLGIPFAEPPVGNLRFKDPVPYSGSLNG CC ************************************************** CC SEQRES QKFTSYGPSCMQQNPEGTFEENLGKTALDLVMQSKVFQAVLPQSEDCLTI CC ATOM QKFTSYGPSCMQQNPEGTFEENLGKTALDLVMQSKVFQAVLPQSEDCLTI CC ************************************************** CC SEQRES NVVRPPGTKAGANLPVMLWIFGGGFEIGSPTIFPPAQMVTKSVLMGKPII CC ATOM NVVRPPGTKAGANLPVMLWIFGGGFEIGSPTIFPPAQMVTKSVLMGKPII CC ************************************************** CC SEQRES HVAVNYRVASWGFLAGDDIKAEGSGNAGLKDQRLGMQWVADNIAGFGGDP CC ATOM HVAVNYRVASWGFLAGDDIKAEGSGNAGLKDQRLGMQWVADNIAGFGGDP CC ************************************************** CC SEQRES SKVTIFGESAGSMSVLCHLIWNDGDNTYKGKPLFRAGIMQSGAMVPSDPV CC ATOM SKVTIFGESAGSMSVLCHLIWNDGDNTYKGKPLFRAGIMQSGAMVPSDPV CC ************************************************** CC SEQRES DGTYGNEIYDLFVSSAGCGSASDKLACLRSASSDTLLDATNNTPGFLAYS CC ATOM DGTYGNEIYDLFVSSAGCGSASDKLACLRSASSDTLLDATNNTPGFLAYS CC ************************************************** CC SEQRES SLRLSYLPRPDGKNITDDMYKLVRDGKYASVPVIIGDQNDEGTVFGLSSL CC ATOM SLRLSYLPRPDGKNITDDMYKLVRDGKYASVPVIIGDQNDEGTVFGLSSL CC ************************************************** CC SEQRES NVTTNAQARAYFKQSFIHASDAEIDTLMAAYPQDITQGSPFDTGIFNAIT CC ATOM NVTTNAQARAYFKQSFIHASDAEIDTLMAAYPQDITQGSPFDTGIFNAIT CC ************************************************** CC SEQRES PQFKRISAVLGDLAFIHARRYFLNHFQGGTKYSFLSKQLSGLPIMGTFHA CC ATOM PQFKRISAVLGDLAFIHARRYFLNHFQGGTKYSFLSKQLSGLPIMGTFHA CC ************************************************** CC SEQRES NDIVWQDYLLGSGSVIYNNAFIAFATDLDPNTAGLLVNWPKYTSSSQSGN CC ATOM NDIVWQDYLLGSGSVIYNNAFIAFATDLDPNTAGLLVNWPKYTSSSQSGN CC ************************************************** CC SEQRES NLMMINALGLYTGKDNFRTAGYDALMTNPSSFFV CC ATOM NLMMINALGLYTGKDNFRTAGYDALMTNPSSFFV CC ********************************** SQ SEQUENCE 534 AA; MW; CN; APTAKLANGD TITGLNAIIN EAFLGIPFAE PPVGNLRFKD PVPYSGSLNG QKFTSYGPSC MQQNPEGTFE ENLGKTALDL VMQSKVFQAV LPQSEDCLTI NVVRPPGTKA GANLPVMLWI FGGGFEIGSP TIFPPAQMVT KSVLMGKPII HVAVNYRVAS WGFLAGDDIK AEGSGNAGLK DQRLGMQWVA DNIAGFGGDP SKVTIFGESA GSMSVLCHLI WNDGDNTYKG KPLFRAGIMQ SGAMVPSDPV DGTYGNEIYD LFVSSAGCGS ASDKLACLRS ASSDTLLDAT NNTPGFLAYS SLRLSYLPRP DGKNITDDMY KLVRDGKYAS VPVIIGDQND EGTVFGLSSL NVTTNAQARA YFKQSFIHAS DAEIDTLMAA YPQDITQGSP FDTGIFNAIT PQFKRISAVL GDLAFIHARR YFLNHFQGGT KYSFLSKQLS GLPIMGTFHA NDIVWQDYLL GSGSVIYNNA FIAFATDLDP NTAGLLVNWP KYTSSSQSGN NLMMINALGL YTGKDNFRTA GYDALMTNPS SFFV //