ID 1WRAA STANDARD; PRT; 308 AA. DT CONVERTED FROM PDB (SEQRES) 1WRA DE Teichoic acid phosphorylcholine esterase/choline binding protein E (cbpE) OS Streptococcus pneumoniae R6 CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.000 CC R-Factor 0.176 FT #SUB 117 143 ASN A 1 27 GLU B Protein S 1 FT #SUB 179 205 TRP A 1 27 GLU B Protein S 2 FT #SUB 206 232 VAL A 1 27 GLU B Protein A 4 FT #SUB 206 232 VAL A 2 28 SER B Protein A 4 FT #SUB 207 233 HIS A 1 27 GLU B Protein S 6 FT #SUB 233 259 LYS A 2 28 SER B Protein S 1 FT #SUB 259 285 ASN A 73 99 SER B Protein S 4 FT #SUB 259 285 ASN A 75 101 GLN B Protein S 5 FT #SUB 264 290 GLU A 304 330 LYS B Protein S 2 FT #HET 35 61 GLU A 4 404 CA A S 2 FT #HET 36 62 ASP A 3 403 CA A S 3 FT #HET 36 62 ASP A 4 404 CA A A 5 FT #HET 37 63 TYR A 11 507 MPD A S 3 FT #HET 38 64 ASP A 4 404 CA A B 2 FT #HET 41 67 ASP A 10 506 MPD A B 1 FT #HET 49 75 TRP A 10 506 MPD A S 5 FT #HET 52 78 GLY A 5 501 PC A B 1 FT #HET 57 83 TYR A 11 507 MPD A S 1 FT #HET 62 88 THR A 8 504 MPD A S 1 FT #HET 66 92 PHE A 8 504 MPD A S 1 FT #HET 75 101 GLN A 7 503 MPD A S 1 FT #HET 84 110 HIS A 1 401 FE A S 3 FT #HET 86 112 HIS A 1 401 FE A S 4 FT #HET 86 112 HIS A 5 501 PC A S 4 FT #HET 87 113 SER A 5 501 PC A S 1 FT #HET 88 114 ASP A 2 402 FE A S 3 FT #HET 88 114 ASP A 5 501 PC A S 3 FT #HET 89 115 HIS A 2 402 FE A S 3 FT #HET 91 117 GLY A 3 403 CA A B 2 FT #HET 94 120 ASP A 3 403 CA A S 3 FT #HET 95 121 GLU A 3 403 CA A S 3 FT #HET 97 123 LEU A 9 505 MPD A B 1 FT #HET 99 125 THR A 7 503 MPD A A 2 FT #HET 99 125 THR A 9 505 MPD A B 2 FT #HET 100 126 TYR A 7 503 MPD A S 2 FT #HET 100 126 TYR A 9 505 MPD A B 3 FT #HET 101 127 PRO A 9 505 MPD A B 1 FT #HET 122 148 TRP A 5 501 PC A S 4 FT #HET 138 164 THR A 9 505 MPD A S 1 FT #HET 182 208 ASN A 1 401 FE A S 3 FT #HET 182 208 ASN A 5 501 PC A S 3 FT #HET 202 228 ASP A 1 401 FE A S 3 FT #HET 202 228 ASP A 2 402 FE A S 3 FT #HET 202 228 ASP A 5 501 PC A S 3 FT #HET 227 253 HIS A 5 501 PC A S 10 FT #HET 228 254 HIS A 2 402 FE A S 3 FT #HET 228 254 HIS A 5 501 PC A S 2 FT #HET 229 255 HIS A 6 502 MPD A S 4 FT #HET 254 280 SER A 6 502 MPD A S 2 FT #HET 257 283 TRP A 6 502 MPD A S 7 FT DISORDER 1 3 CC SEQUENCE 305 AA (ATOM); CC GNKIHFINVQ EGGSDAIILE SNGHFAMVDT GEDYDFPDGS DSRYPWREGI ETSYKHVLTD CC RVFRRLKELS VQKLDFILVT HTHSDHIGNV DELLSTYPVD RVYLKKYSDS RITNSERLWD CC NLYGYDKVLQ TATETGVSVI QNITQGDAHF QFGDMDIQLY NYENETDSSG ELKKIWDDNS CC NSLISVVKVN GKKIYLGGDL DNVHGAEDKY GPLIGKVDLM KFNHHHDTNK SNTKDFIKNL CC SPSLIVQTSD SLPWKNGVDS EYVNWLKERG IERINAASKD YDATVFDIRK DGFVNISTSY CC KPIPS CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES ESSGNKIHFINVQEGGSDAIILESNGHFAMVDTGEDYDFPDGSDSRYPWR CC ATOM ---GNKIHFINVQEGGSDAIILESNGHFAMVDTGEDYDFPDGSDSRYPWR CC *********************************************** CC SEQRES EGIETSYKHVLTDRVFRRLKELSVQKLDFILVTHTHSDHIGNVDELLSTY CC ATOM EGIETSYKHVLTDRVFRRLKELSVQKLDFILVTHTHSDHIGNVDELLSTY CC ************************************************** CC SEQRES PVDRVYLKKYSDSRITNSERLWDNLYGYDKVLQTATETGVSVIQNITQGD CC ATOM PVDRVYLKKYSDSRITNSERLWDNLYGYDKVLQTATETGVSVIQNITQGD CC ************************************************** CC SEQRES AHFQFGDMDIQLYNYENETDSSGELKKIWDDNSNSLISVVKVNGKKIYLG CC ATOM AHFQFGDMDIQLYNYENETDSSGELKKIWDDNSNSLISVVKVNGKKIYLG CC ************************************************** CC SEQRES GDLDNVHGAEDKYGPLIGKVDLMKFNHHHDTNKSNTKDFIKNLSPSLIVQ CC ATOM GDLDNVHGAEDKYGPLIGKVDLMKFNHHHDTNKSNTKDFIKNLSPSLIVQ CC ************************************************** CC SEQRES TSDSLPWKNGVDSEYVNWLKERGIERINAASKDYDATVFDIRKDGFVNIS CC ATOM TSDSLPWKNGVDSEYVNWLKERGIERINAASKDYDATVFDIRKDGFVNIS CC ************************************************** CC SEQRES TSYKPIPS CC ATOM TSYKPIPS CC ******** SQ SEQUENCE 308 AA; MW; CN; ESSGNKIHFI NVQEGGSDAI ILESNGHFAM VDTGEDYDFP DGSDSRYPWR EGIETSYKHV LTDRVFRRLK ELSVQKLDFI LVTHTHSDHI GNVDELLSTY PVDRVYLKKY SDSRITNSER LWDNLYGYDK VLQTATETGV SVIQNITQGD AHFQFGDMDI QLYNYENETD SSGELKKIWD DNSNSLISVV KVNGKKIYLG GDLDNVHGAE DKYGPLIGKV DLMKFNHHHD TNKSNTKDFI KNLSPSLIVQ TSDSLPWKNG VDSEYVNWLK ERGIERINAA SKDYDATVFD IRKDGFVNIS TSYKPIPS // ID 1WRAB STANDARD; PRT; 308 AA. DT CONVERTED FROM PDB (SEQRES) 1WRA DE Teichoic acid phosphorylcholine esterase/choline binding protein E (cbpE) OS Streptococcus pneumoniae R6 CC EXPDTA X-RAY DIFFRACTION CC RESOLU 2.000 CC R-Factor 0.176 FT #SUB 1 27 GLU B 117 143 ASN A Protein B 1 FT #SUB 1 27 GLU B 179 205 TRP A Protein A 2 FT #SUB 1 27 GLU B 206 232 VAL A Protein A 4 FT #SUB 1 27 GLU B 207 233 HIS A Protein S 6 FT #SUB 2 28 SER B 206 232 VAL A Protein A 4 FT #SUB 2 28 SER B 233 259 LYS A Protein S 1 FT #SUB 73 99 SER B 259 285 ASN A Protein A 4 FT #SUB 75 101 GLN B 259 285 ASN A Protein S 5 FT #SUB 304 330 LYS B 264 290 GLU A Protein S 2 FT #HET 35 61 GLU B 14 403 CA B S 2 FT #HET 36 62 ASP B 14 403 CA B A 5 FT #HET 36 62 ASP B 15 404 CA B S 3 FT #HET 38 64 ASP B 14 403 CA B B 2 FT #HET 41 67 ASP B 21 1506 MPD B B 1 FT #HET 49 75 TRP B 21 1506 MPD B S 7 FT #HET 52 78 GLY B 16 501 PC B B 1 FT #HET 62 88 THR B 20 1505 MPD B S 1 FT #HET 66 92 PHE B 20 1505 MPD B S 4 FT #HET 75 101 GLN B 18 1503 MPD B B 1 FT #HET 84 110 HIS B 12 401 FE B S 3 FT #HET 86 112 HIS B 12 401 FE B S 4 FT #HET 86 112 HIS B 16 501 PC B S 6 FT #HET 87 113 SER B 16 501 PC B S 1 FT #HET 88 114 ASP B 13 402 FE B S 3 FT #HET 88 114 ASP B 16 501 PC B S 5 FT #HET 89 115 HIS B 13 402 FE B S 3 FT #HET 91 117 GLY B 15 404 CA B B 2 FT #HET 94 120 ASP B 15 404 CA B S 3 FT #HET 95 121 GLU B 15 404 CA B S 3 FT #HET 97 123 LEU B 19 1504 MPD B B 1 FT #HET 99 125 THR B 18 1503 MPD B A 2 FT #HET 99 125 THR B 19 1504 MPD B B 2 FT #HET 99 125 THR B 20 1505 MPD B S 1 FT #HET 100 126 TYR B 18 1503 MPD B S 3 FT #HET 100 126 TYR B 19 1504 MPD B B 2 FT #HET 101 127 PRO B 18 1503 MPD B S 1 FT #HET 101 127 PRO B 19 1504 MPD B B 1 FT #HET 122 148 TRP B 16 501 PC B S 5 FT #HET 138 164 THR B 19 1504 MPD B B 1 FT #HET 182 208 ASN B 12 401 FE B S 3 FT #HET 182 208 ASN B 16 501 PC B S 3 FT #HET 202 228 ASP B 12 401 FE B S 3 FT #HET 202 228 ASP B 13 402 FE B S 3 FT #HET 202 228 ASP B 16 501 PC B S 3 FT #HET 227 253 HIS B 16 501 PC B S 9 FT #HET 228 254 HIS B 13 402 FE B S 3 FT #HET 228 254 HIS B 16 501 PC B S 2 FT #HET 229 255 HIS B 17 1502 MPD B S 3 FT #HET 257 283 TRP B 17 1502 MPD B S 7 CC SEQUENCE 308 AA (ATOM); CC ESSGNKIHFI NVQEGGSDAI ILESNGHFAM VDTGEDYDFP DGSDSRYPWR EGIETSYKHV CC LTDRVFRRLK ELSVQKLDFI LVTHTHSDHI GNVDELLSTY PVDRVYLKKY SDSRITNSER CC LWDNLYGYDK VLQTATETGV SVIQNITQGD AHFQFGDMDI QLYNYENETD SSGELKKIWD CC DNSNSLISVV KVNGKKIYLG GDLDNVHGAE DKYGPLIGKV DLMKFNHHHD TNKSNTKDFI CC KNLSPSLIVQ TSDSLPWKNG VDSEYVNWLK ERGIERINAA SKDYDATVFD IRKDGFVNIS CC TSYKPIPS CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES ESSGNKIHFINVQEGGSDAIILESNGHFAMVDTGEDYDFPDGSDSRYPWR CC ATOM ESSGNKIHFINVQEGGSDAIILESNGHFAMVDTGEDYDFPDGSDSRYPWR CC ************************************************** CC SEQRES EGIETSYKHVLTDRVFRRLKELSVQKLDFILVTHTHSDHIGNVDELLSTY CC ATOM EGIETSYKHVLTDRVFRRLKELSVQKLDFILVTHTHSDHIGNVDELLSTY CC ************************************************** CC SEQRES PVDRVYLKKYSDSRITNSERLWDNLYGYDKVLQTATETGVSVIQNITQGD CC ATOM PVDRVYLKKYSDSRITNSERLWDNLYGYDKVLQTATETGVSVIQNITQGD CC ************************************************** CC SEQRES AHFQFGDMDIQLYNYENETDSSGELKKIWDDNSNSLISVVKVNGKKIYLG CC ATOM AHFQFGDMDIQLYNYENETDSSGELKKIWDDNSNSLISVVKVNGKKIYLG CC ************************************************** CC SEQRES GDLDNVHGAEDKYGPLIGKVDLMKFNHHHDTNKSNTKDFIKNLSPSLIVQ CC ATOM GDLDNVHGAEDKYGPLIGKVDLMKFNHHHDTNKSNTKDFIKNLSPSLIVQ CC ************************************************** CC SEQRES TSDSLPWKNGVDSEYVNWLKERGIERINAASKDYDATVFDIRKDGFVNIS CC ATOM TSDSLPWKNGVDSEYVNWLKERGIERINAASKDYDATVFDIRKDGFVNIS CC ************************************************** CC SEQRES TSYKPIPS CC ATOM TSYKPIPS CC ******** SQ SEQUENCE 308 AA; MW; CN; ESSGNKIHFI NVQEGGSDAI ILESNGHFAM VDTGEDYDFP DGSDSRYPWR EGIETSYKHV LTDRVFRRLK ELSVQKLDFI LVTHTHSDHI GNVDELLSTY PVDRVYLKKY SDSRITNSER LWDNLYGYDK VLQTATETGV SVIQNITQGD AHFQFGDMDI QLYNYENETD SSGELKKIWD DNSNSLISVV KVNGKKIYLG GDLDNVHGAE DKYGPLIGKV DLMKFNHHHD TNKSNTKDFI KNLSPSLIVQ TSDSLPWKNG VDSEYVNWLK ERGIERINAA SKDYDATVFD IRKDGFVNIS TSYKPIPS //