ID 2BIBA STANDARD; PRT; 547 AA. DT CONVERTED FROM PDB (SEQRES) 2BIB DE TEICHOIC ACID PHOSPHORYLCHOLINE ESTERASE/ CHOLINE BINDING PROTEIN OS STREPTOCOCCUS PNEUMONIAE CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.920 CC R-Factor 0.197 FT #HET 36 36 GLU A 11 1551 CA A S 2 FT #HET 37 37 ASP A 11 1551 CA A A 5 FT #HET 37 37 ASP A 12 1552 CA A S 3 FT #HET 39 39 ASP A 11 1551 CA A B 2 FT #HET 53 53 GLY A 1 1541 PC A B 1 FT #HET 85 85 HIS A 10 1550 ZN A S 3 FT #HET 87 87 HIS A 1 1541 PC A S 5 FT #HET 87 87 HIS A 10 1550 ZN A S 4 FT #HET 88 88 SER A 1 1541 PC A S 1 FT #HET 89 89 ASP A 1 1541 PC A S 5 FT #HET 89 89 ASP A 9 1549 ZN A S 3 FT #HET 90 90 HIS A 1 1541 PC A S 1 FT #HET 90 90 HIS A 9 1549 ZN A S 3 FT #HET 90 90 HIS A 10 1550 ZN A S 1 FT #HET 92 92 GLY A 12 1552 CA A B 2 FT #HET 95 95 ASP A 12 1552 CA A S 3 FT #HET 96 96 GLU A 12 1552 CA A S 3 FT #HET 123 123 TRP A 1 1541 PC A S 7 FT #HET 183 183 ASN A 1 1541 PC A S 3 FT #HET 183 183 ASN A 10 1550 ZN A S 3 FT #HET 203 203 ASP A 1 1541 PC A S 5 FT #HET 203 203 ASP A 9 1549 ZN A S 3 FT #HET 203 203 ASP A 10 1550 ZN A S 3 FT #HET 228 228 HIS A 1 1541 PC A S 8 FT #HET 229 229 HIS A 1 1541 PC A S 2 FT #HET 229 229 HIS A 9 1549 ZN A S 3 FT #HET 323 323 TRP A 4 1544 BTB A S 14 FT #HET 333 333 TYR A 4 1544 BTB A S 3 FT #HET 337 337 TRP A 3 1543 BTB A S 6 FT #HET 344 344 TRP A 3 1543 BTB A S 6 FT #HET 350 350 THR A 4 1544 BTB A B 4 FT #HET 351 351 GLY A 4 1544 BTB A B 3 FT #HET 352 352 ILE A 4 1544 BTB A S 1 FT #HET 361 361 TRP A 3 1543 BTB A S 2 FT #HET 366 366 PHE A 3 1543 BTB A S 3 FT #HET 378 378 TRP A 6 1546 BTB A S 7 FT #HET 385 385 TRP A 6 1546 BTB A S 7 FT #HET 391 391 GLU A 3 1543 BTB A B 3 FT #HET 392 392 ASN A 3 1543 BTB A S 4 FT #HET 398 398 TRP A 5 1545 BTB A S 10 FT #HET 405 405 TRP A 5 1545 BTB A S 5 FT #HET 406 406 TYR A 6 1546 BTB A S 4 FT #HET 414 414 MET A 6 1546 BTB A S 3 FT #HET 418 418 TRP A 2 1542 BTB A S 4 FT #HET 425 425 TRP A 2 1542 BTB A S 11 FT #HET 426 426 TYR A 5 1545 BTB A S 1 FT #HET 431 431 SER A 6 1546 BTB A A 7 FT #HET 434 434 MET A 5 1545 BTB A S 1 FT #HET 438 438 TRP A 7 1547 BTB A S 6 FT #HET 445 445 TRP A 7 1547 BTB A S 12 FT #HET 446 446 TYR A 2 1542 BTB A S 4 FT #HET 451 451 THR A 5 1545 BTB A A 5 FT #HET 454 454 MET A 2 1542 BTB A S 2 FT #HET 466 466 TYR A 7 1547 BTB A S 4 FT #HET 471 471 SER A 2 1542 BTB A A 6 FT #HET 478 478 TRP A 8 1548 BTB A S 10 FT #HET 485 485 TRP A 8 1548 BTB A S 5 FT #HET 491 491 ASP A 7 1547 BTB A B 7 FT #HET 506 506 TYR A 8 1548 BTB A S 6 FT #HET 514 514 LEU A 8 1548 BTB A S 2 FT #HET 529 529 SER A 8 1548 BTB A A 9 FT DISORDER 542 547 CC Miss-BB 1 CC Miss-SC 1 CC SEQUENCE 540 AA (ATOM); CC QESSGNKIHF INVQEGGSDA IILESNGHFA MVDTGEDYDF PDGSDSRYPW REGIETSYKH CC VLTDRVFRRL KELSVQKLDF ILVTHTHSDH IGNVDELLST YPVDRVYLKK YSDSRITNSE CC RLWDNLYGYD KVLQTATETG VSVIQNITQG DAHFQFGDMD IQLYNYENET DSSGELKKIW CC DDNSNSLISV VKVNGKKIYL GGDLDNVHGA EDKYGPLIGK VDLMKFNHHH DTNKSNTKDF CC IKNLSPSLIV QTSDSLPWKN GVDSEYVNWL KERGIERINA ASKDYDATVF DIRKDGFVNI CC STSYKPIPSF QAGWHKSAYG NWWYQAPDST GEYAVGWNEI EGEWYYFNQT GILLQNQWKK CC WNNHWFYLTD SGASAKNWKK IDGIWYYFNK ENQMEIGWVQ DKEQWYYLDV DGSMKTGWLQ CC YMGQWYYFAP SGEMKMGWVK DKETWYYMDS TGVMKTGEIE VAGQHYYLED SGAMKQGWHK CC KANDWYFYKT DGSRAVGWIK DKDKWYFLKE NGQLLVNGKT PEGYTVDSSG AWLVDVSIEK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES QESSGNKIHFINVQEGGSDAIILESNGHFAMVDTGEDYDFPDGSDSRYPW CC ATOM QESSGNKIHFINVQEGGSDAIILESNGHFAMVDTGEDYDFPDGSDSRYPW CC ************************************************** CC SEQRES REGIETSYKHVLTDRVFRRLKELSVQKLDFILVTHTHSDHIGNVDELLST CC ATOM REGIETSYKHVLTDRVFRRLKELSVQKLDFILVTHTHSDHIGNVDELLST CC ************************************************** CC SEQRES YPVDRVYLKKYSDSRITNSERLWDNLYGYDKVLQTATETGVSVIQNITQG CC ATOM YPVDRVYLKKYSDSRITNSERLWDNLYGYDKVLQTATETGVSVIQNITQG CC ************************************************** CC SEQRES DAHFQFGDMDIQLYNYENETDSSGELKKIWDDNSNSLISVVKVNGKKIYL CC ATOM DAHFQFGDMDIQLYNYENETDSSGELKKIWDDNSNSLISVVKVNGKKIYL CC ************************************************** CC SEQRES GGDLDNVHGAEDKYGPLIGKVDLMKFNHHHDTNKSNTKDFIKNLSPSLIV CC ATOM GGDLDNVHGAEDKYGPLIGKVDLMKFNHHHDTNKSNTKDFIKNLSPSLIV CC ************************************************** CC SEQRES QTSDSLPWKNGVDSEYVNWLKERGIERINAASKDYDATVFDIRKDGFVNI CC ATOM QTSDSLPWKNGVDSEYVNWLKERGIERINAASKDYDATVFDIRKDGFVNI CC ************************************************** CC SEQRES STSYKPIPSFQAGWHKSAYGNWWYQAPDSTGEYAVGWNEIEGEWYYFNQT CC ATOM STSYKPIPSFQAGWHKSAYGNWWYQAPDSTGEYAVGWNEIEGEWYYFNQT CC ************************************************** CC SEQRES GILLQNQWKKWNNHWFYLTDSGASAKNWKKIDGIWYYFNKENQMEIGWVQ CC ATOM GILLQNQWKKWNNHWFYLTDSGASAKNWKKIDGIWYYFNKENQMEIGWVQ CC ************************************************** CC SEQRES DKEQWYYLDVDGSMKTGWLQYMGQWYYFAPSGEMKMGWVKDKETWYYMDS CC ATOM DKEQWYYLDVDGSMKTGWLQYMGQWYYFAPSGEMKMGWVKDKETWYYMDS CC ************************************************** CC SEQRES TGVMKTGEIEVAGQHYYLEDSGAMKQGWHKKANDWYFYKTDGSRAVGWIK CC ATOM TGVMKTGEIEVAGQHYYLEDSGAMKQGWHKKANDWYFYKTDGSRAVGWIK CC ************************************************** CC SEQRES DKDKWYFLKENGQLLVNGKTPEGYTVDSSGAWLVDVSIEKSATIKTT CC ATOM DKDKWYFLKENGQLLVNGKTPEGYTVDSSGAWLVDVSIEKS------ CC ***************************************** SQ SEQUENCE 547 AA; MW; CN; QESSGNKIHF INVQEGGSDA IILESNGHFA MVDTGEDYDF PDGSDSRYPW REGIETSYKH VLTDRVFRRL KELSVQKLDF ILVTHTHSDH IGNVDELLST YPVDRVYLKK YSDSRITNSE RLWDNLYGYD KVLQTATETG VSVIQNITQG DAHFQFGDMD IQLYNYENET DSSGELKKIW DDNSNSLISV VKVNGKKIYL GGDLDNVHGA EDKYGPLIGK VDLMKFNHHH DTNKSNTKDF IKNLSPSLIV QTSDSLPWKN GVDSEYVNWL KERGIERINA ASKDYDATVF DIRKDGFVNI STSYKPIPSF QAGWHKSAYG NWWYQAPDST GEYAVGWNEI EGEWYYFNQT GILLQNQWKK WNNHWFYLTD SGASAKNWKK IDGIWYYFNK ENQMEIGWVQ DKEQWYYLDV DGSMKTGWLQ YMGQWYYFAP SGEMKMGWVK DKETWYYMDS TGVMKTGEIE VAGQHYYLED SGAMKQGWHK KANDWYFYKT DGSRAVGWIK DKDKWYFLKE NGQLLVNGKT PEGYTVDSSG AWLVDVSIEK SATIKTT //