ID 6B1XA STANDARD; PRT; 268 AA. DT CONVERTED FROM PDB (SEQRES) 6B1X DE Carbapenem-hydrolyzing beta-lactamase KPC OS Klebsiella pneumoniae CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.450 CC R-Factor 0.147 FT #SUB 78 100 ASN A 70 92 ASP B Protein S 3 FT #SUB 78 100 ASN A 72 94 PRO B Protein A 3 FT #SUB 78 100 ASN A 74 96 ARG B Protein B 1 FT #SUB 114 136 ASN A 74 96 ARG B Protein S 2 FT #SUB 118 140 LYS A 92 114 THR B Protein A 2 FT #SUB 121 143 GLY A 92 114 THR B Protein B 5 FT #SUB 124 146 ALA A 77 99 LYS B Protein S 1 FT #SUB 141 163 ASP A 76 98 GLY B Protein B 1 FT #SUB 143 165 TRP A 74 96 ARG B Protein S 7 FT #SUB 143 165 TRP A 75 97 TYR B Protein S 4 FT #SUB 143 165 TRP A 91 113 LEU B Protein S 1 FT #SUB 143 165 TRP A 92 114 THR B Protein S 4 FT #SUB 156 178 ARG A 78 100 ASN B Protein S 2 FT #HET 47 69 CYS A 1 301 C9D A A 2 FT #HET 48 70 SER A 1 301 C9D A A 14 FT #HET 51 73 LYS A 1 301 C9D A S 1 FT #HET 60 82 ALA A 4 304 EDO A A 4 FT #HET 63 85 GLN A 4 304 EDO A S 2 FT #HET 64 86 GLN A 4 304 EDO A S 4 FT #HET 74 96 ARG A 5 305 EDO A S 9 FT #HET 75 97 TYR A 2 302 CIT A A 3 FT #HET 76 98 GLY A 2 302 CIT A B 10 FT #HET 77 99 LYS A 2 302 CIT A B 1 FT #HET 78 100 ASN A 2 302 CIT A A 11 FT #HET 79 101 ALA A 2 302 CIT A A 6 FT #HET 83 105 TRP A 1 301 C9D A S 14 FT #HET 86 108 ILE A 3 303 EDO A S 1 FT #HET 93 115 THR A 5 305 EDO A B 3 FT #HET 102 124 ALA A 3 303 EDO A A 5 FT #HET 103 125 ALA A 3 303 EDO A B 2 FT #HET 106 128 GLN A 3 303 EDO A S 4 FT #HET 107 129 TYR A 3 303 EDO A S 3 FT #HET 108 130 SER A 1 301 C9D A A 10 FT #HET 110 132 ASN A 1 301 C9D A S 4 FT #HET 144 166 GLU A 1 301 C9D A S 1 FT #HET 145 167 LEU A 1 301 C9D A A 2 FT #HET 148 170 ASN A 1 301 C9D A S 6 FT #HET 156 178 ARG A 9 302 CIT B S 9 FT #HET 175 197 SER A 7 307 EDO A S 1 FT #HET 179 201 ALA A 7 307 EDO A S 1 FT #HET 182 204 ARG A 7 307 EDO A S 7 FT #HET 183 205 GLN A 6 306 EDO A S 1 FT #HET 186 208 VAL A 6 306 EDO A S 2 FT #HET 190 212 LYS A 6 306 EDO A S 7 FT #HET 194 216 THR A 1 301 C9D A S 3 FT #HET 208 230 ALA A 6 306 EDO A S 1 FT #HET 212 234 LYS A 1 301 C9D A S 1 FT #HET 213 235 THR A 1 301 C9D A A 9 FT #HET 214 236 GLY A 1 301 C9D A B 8 FT #HET 215 237 THR A 1 301 C9D A A 12 FT #HET 216 238 CYS A 1 301 C9D A B 1 FT #HET 229 251 TRP A 6 306 EDO A S 8 CC SEQUENCE 268 AA (ATOM); CC ATALTNLVAE PFAKLEQDFG GSIGVYAMDT GSGATVSYRA EERFPLCSSF KGFLAAAVLA CC RSQQQAGLLD TPIRYGKNAL VPWSPISEKY LTTGMTVAEL SAAAVQYSDN AAANLLLKEL CC GGPAGLTAFM RSIGDTTFRL DRWELELNSA IPGDARDTSS PRAVTESLQK LTLGSALAAP CC QRQQFVDWLK GNTTGNHRIR AAVPADWAVG DKTGTCGVYG TANDYAVVWP TGRAPIVLAV CC YTRAPNKDDK HSEAVIAAAA RLALEGLG CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES ATALTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSF CC ATOM ATALTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSF CC ************************************************** CC SEQRES KGFLAAAVLARSQQQAGLLDTPIRYGKNALVPWSPISEKYLTTGMTVAEL CC ATOM KGFLAAAVLARSQQQAGLLDTPIRYGKNALVPWSPISEKYLTTGMTVAEL CC ************************************************** CC SEQRES SAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDRWELELNSA CC ATOM SAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDRWELELNSA CC ************************************************** CC SEQRES IPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIR CC ATOM IPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIR CC ************************************************** CC SEQRES AAVPADWAVGDKTGTCGVYGTANDYAVVWPTGRAPIVLAVYTRAPNKDDK CC ATOM AAVPADWAVGDKTGTCGVYGTANDYAVVWPTGRAPIVLAVYTRAPNKDDK CC ************************************************** CC SEQRES HSEAVIAAAARLALEGLG CC ATOM HSEAVIAAAARLALEGLG CC ****************** SQ SEQUENCE 268 AA; MW; CN; ATALTNLVAE PFAKLEQDFG GSIGVYAMDT GSGATVSYRA EERFPLCSSF KGFLAAAVLA RSQQQAGLLD TPIRYGKNAL VPWSPISEKY LTTGMTVAEL SAAAVQYSDN AAANLLLKEL GGPAGLTAFM RSIGDTTFRL DRWELELNSA IPGDARDTSS PRAVTESLQK LTLGSALAAP QRQQFVDWLK GNTTGNHRIR AAVPADWAVG DKTGTCGVYG TANDYAVVWP TGRAPIVLAV YTRAPNKDDK HSEAVIAAAA RLALEGLG // ID 6B1XB STANDARD; PRT; 268 AA. DT CONVERTED FROM PDB (SEQRES) 6B1X DE Carbapenem-hydrolyzing beta-lactamase KPC OS Klebsiella pneumoniae CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.450 CC R-Factor 0.147 FT #SUB 70 92 ASP B 78 100 ASN A Protein A 3 FT #SUB 72 94 PRO B 78 100 ASN A Protein S 3 FT #SUB 74 96 ARG B 78 100 ASN A Protein S 1 FT #SUB 74 96 ARG B 114 136 ASN A Protein S 2 FT #SUB 74 96 ARG B 143 165 TRP A Protein A 7 FT #SUB 75 97 TYR B 143 165 TRP A Protein B 4 FT #SUB 76 98 GLY B 141 163 ASP A Protein B 1 FT #SUB 77 99 LYS B 124 146 ALA A Protein S 1 FT #SUB 78 100 ASN B 156 178 ARG A Protein S 2 FT #SUB 91 113 LEU B 143 165 TRP A Protein B 1 FT #SUB 92 114 THR B 118 140 LYS A Protein B 2 FT #SUB 92 114 THR B 121 143 GLY A Protein S 5 FT #SUB 92 114 THR B 143 165 TRP A Protein B 4 FT #HET 47 69 CYS B 8 301 C9D B A 2 FT #HET 48 70 SER B 8 301 C9D B A 15 FT #HET 51 73 LYS B 8 301 C9D B S 1 FT #HET 72 94 PRO B 11 304 EDO B S 2 FT #HET 74 96 ARG B 2 302 CIT A S 3 FT #HET 78 100 ASN B 9 302 CIT B A 3 FT #HET 79 101 ALA B 9 302 CIT B A 3 FT #HET 83 105 TRP B 8 301 C9D B S 15 FT #HET 90 112 TYR B 12 305 EDO B S 3 FT #HET 93 115 THR B 11 304 EDO B B 1 FT #HET 93 115 THR B 12 305 EDO B S 3 FT #HET 94 116 GLY B 11 304 EDO B B 3 FT #HET 94 116 GLY B 12 305 EDO B B 2 FT #HET 96 118 THR B 11 304 EDO B S 1 FT #HET 99 121 GLU B 10 303 EDO B B 1 FT #HET 99 121 GLU B 12 305 EDO B S 6 FT #HET 102 124 ALA B 10 303 EDO B A 4 FT #HET 103 125 ALA B 10 303 EDO B B 3 FT #HET 106 128 GLN B 10 303 EDO B S 4 FT #HET 107 129 TYR B 10 303 EDO B S 3 FT #HET 108 130 SER B 8 301 C9D B A 8 FT #HET 110 132 ASN B 8 301 C9D B S 4 FT #HET 118 140 LYS B 9 302 CIT B S 6 FT #HET 144 166 GLU B 8 301 C9D B S 1 FT #HET 145 167 LEU B 8 301 C9D B A 5 FT #HET 148 170 ASN B 8 301 C9D B S 7 FT #HET 194 216 THR B 8 301 C9D B S 3 FT #HET 212 234 LYS B 8 301 C9D B S 1 FT #HET 213 235 THR B 8 301 C9D B A 7 FT #HET 214 236 GLY B 8 301 C9D B B 6 FT #HET 215 237 THR B 8 301 C9D B A 13 FT #HET 216 238 CYS B 8 301 C9D B B 2 FT DISORDER 1 3 CC SEQUENCE 265 AA (ATOM); CC LTNLVAEPFA KLEQDFGGSI GVYAMDTGSG ATVSYRAEER FPLCSSFKGF LAAAVLARSQ CC QQAGLLDTPI RYGKNALVPW SPISEKYLTT GMTVAELSAA AVQYSDNAAA NLLLKELGGP CC AGLTAFMRSI GDTTFRLDRW ELELNSAIPG DARDTSSPRA VTESLQKLTL GSALAAPQRQ CC QFVDWLKGNT TGNHRIRAAV PADWAVGDKT GTCGVYGTAN DYAVVWPTGR APIVLAVYTR CC APNKDDKHSE AVIAAAARLA LEGLG CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES ATALTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSF CC ATOM ---LTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSF CC *********************************************** CC SEQRES KGFLAAAVLARSQQQAGLLDTPIRYGKNALVPWSPISEKYLTTGMTVAEL CC ATOM KGFLAAAVLARSQQQAGLLDTPIRYGKNALVPWSPISEKYLTTGMTVAEL CC ************************************************** CC SEQRES SAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDRWELELNSA CC ATOM SAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDRWELELNSA CC ************************************************** CC SEQRES IPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIR CC ATOM IPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIR CC ************************************************** CC SEQRES AAVPADWAVGDKTGTCGVYGTANDYAVVWPTGRAPIVLAVYTRAPNKDDK CC ATOM AAVPADWAVGDKTGTCGVYGTANDYAVVWPTGRAPIVLAVYTRAPNKDDK CC ************************************************** CC SEQRES HSEAVIAAAARLALEGLG CC ATOM HSEAVIAAAARLALEGLG CC ****************** SQ SEQUENCE 268 AA; MW; CN; ATALTNLVAE PFAKLEQDFG GSIGVYAMDT GSGATVSYRA EERFPLCSSF KGFLAAAVLA RSQQQAGLLD TPIRYGKNAL VPWSPISEKY LTTGMTVAEL SAAAVQYSDN AAANLLLKEL GGPAGLTAFM RSIGDTTFRL DRWELELNSA IPGDARDTSS PRAVTESLQK LTLGSALAAP QRQQFVDWLK GNTTGNHRIR AAVPADWAVG DKTGTCGVYG TANDYAVVWP TGRAPIVLAV YTRAPNKDDK HSEAVIAAAA RLALEGLG //