ID 3BFFA STANDARD; PRT; 262 AA. DT CONVERTED FROM PDB (SEQRES) 3BFF DE Class A beta-lactamase Sed1 OS Citrobacter sedlakii CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.900 CC R-Factor 0.189 FT #SUB 169 195 LEU A 178 204 ARG B Protein B 3 FT #SUB 170 196 GLY A 178 204 ARG B Protein B 2 FT #SUB 171 197 ASP A 174 200 ALA B Protein S 5 FT #SUB 171 197 ASP A 175 201 GLY B Protein S 4 FT #SUB 171 197 ASP A 178 204 ARG B Protein S 2 FT #SUB 174 200 ALA A 171 197 ASP B Protein A 4 FT #SUB 175 201 GLY A 171 197 ASP B Protein B 6 FT #SUB 178 204 ARG A 169 195 LEU B Protein S 3 FT #SUB 178 204 ARG A 170 196 GLY B Protein S 2 FT #SUB 178 204 ARG A 171 197 ASP B Protein S 3 FT #SUB 178 204 ARG A 178 204 ARG B Protein S 15 FT #SUB 186 212 LYS A 227 255 ASP B Protein S 2 FT #SUB 204 230 VAL A 226 254 GLU B Protein S 3 FT #SUB 226 254 GLU A 204 230 VAL B Protein B 3 FT #SUB 227 255 ASP A 186 212 LYS B Protein B 2 FT #SUB 227 255 ASP A 204 230 VAL B Protein B 1 FT #SUB 72 98 LYS A 245 273 LYS C Protein S 1 FT #SUB 85 111 LYS A 78 104 ASN C Protein B 2 FT #SUB 86 112 TYR A 77 103 THR C Protein S 1 FT #SUB 86 112 TYR A 78 104 ASN C Protein S 7 FT #SUB 89 115 ASN A 246 274 TRP C Protein S 2 FT #SUB 102 128 GLN A 73 99 LYS C Protein S 4 FT #HET 43 69 CYS A 2 301 SFR A A 2 FT #HET 44 70 SER A 2 301 SFR A A 16 FT #HET 47 73 LYS A 2 301 SFR A S 1 FT #HET 79 105 TRP A 2 301 SFR A S 3 FT #HET 104 130 SER A 2 301 SFR A S 6 FT #HET 106 132 ASN A 2 301 SFR A S 5 FT #HET 140 166 GLU A 2 301 SFR A S 1 FT #HET 144 170 ASN A 2 301 SFR A S 5 FT #HET 190 216 THR A 2 301 SFR A S 2 FT #HET 197 223 ALA A 1 2 SCN A B 1 FT #HET 208 234 LYS A 2 301 SFR A S 1 FT #HET 209 235 THR A 2 301 SFR A A 9 FT #HET 210 236 GLY A 2 301 SFR A B 6 FT #HET 211 237 ALA A 2 301 SFR A B 9 FT #HET 256 284 LYS A 1 2 SCN A S 3 CC SEQUENCE 262 AA (ATOM); CC VQQVQKKLAA LEKQSGGRLG VALINTADNS QVLYRADERF AMCSTSKVMT AAAVLKQSET CC HDGILQQKMT IKKADLTNWN PVTEKYVGNT MTLAELSAAT LQYSDNTAMN KLLAHLGGPG CC NVTAFARSIG DTTFRLDRKE PELNTAIPGD ERDTTSPLAM AKSLRKLTLG DALAGPQRAQ CC LVDWLKGNTT GGQSIRAGLP AHWVVGDKTG ACDYGTTNDI AVIWPEDRAP LVLVTYFTQP CC QQDAKWRKDV LAAAAKIVTE GK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VQQVQKKLAALEKQSGGRLGVALINTADNSQVLYRADERFAMCSTSKVMT CC ATOM VQQVQKKLAALEKQSGGRLGVALINTADNSQVLYRADERFAMCSTSKVMT CC ************************************************** CC SEQRES AAAVLKQSETHDGILQQKMTIKKADLTNWNPVTEKYVGNTMTLAELSAAT CC ATOM AAAVLKQSETHDGILQQKMTIKKADLTNWNPVTEKYVGNTMTLAELSAAT CC ************************************************** CC SEQRES LQYSDNTAMNKLLAHLGGPGNVTAFARSIGDTTFRLDRKEPELNTAIPGD CC ATOM LQYSDNTAMNKLLAHLGGPGNVTAFARSIGDTTFRLDRKEPELNTAIPGD CC ************************************************** CC SEQRES ERDTTSPLAMAKSLRKLTLGDALAGPQRAQLVDWLKGNTTGGQSIRAGLP CC ATOM ERDTTSPLAMAKSLRKLTLGDALAGPQRAQLVDWLKGNTTGGQSIRAGLP CC ************************************************** CC SEQRES AHWVVGDKTGACDYGTTNDIAVIWPEDRAPLVLVTYFTQPQQDAKWRKDV CC ATOM AHWVVGDKTGACDYGTTNDIAVIWPEDRAPLVLVTYFTQPQQDAKWRKDV CC ************************************************** CC SEQRES LAAAAKIVTEGK CC ATOM LAAAAKIVTEGK CC ************ SQ SEQUENCE 262 AA; MW; CN; VQQVQKKLAA LEKQSGGRLG VALINTADNS QVLYRADERF AMCSTSKVMT AAAVLKQSET HDGILQQKMT IKKADLTNWN PVTEKYVGNT MTLAELSAAT LQYSDNTAMN KLLAHLGGPG NVTAFARSIG DTTFRLDRKE PELNTAIPGD ERDTTSPLAM AKSLRKLTLG DALAGPQRAQ LVDWLKGNTT GGQSIRAGLP AHWVVGDKTG ACDYGTTNDI AVIWPEDRAP LVLVTYFTQP QQDAKWRKDV LAAAAKIVTE GK // ID 3BFFB STANDARD; PRT; 262 AA. DT CONVERTED FROM PDB (SEQRES) 3BFF DE Class A beta-lactamase Sed1 OS Citrobacter sedlakii CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.900 CC R-Factor 0.189 FT #SUB 169 195 LEU B 178 204 ARG A Protein B 3 FT #SUB 170 196 GLY B 178 204 ARG A Protein B 2 FT #SUB 171 197 ASP B 174 200 ALA A Protein S 4 FT #SUB 171 197 ASP B 175 201 GLY A Protein S 6 FT #SUB 171 197 ASP B 178 204 ARG A Protein S 3 FT #SUB 174 200 ALA B 171 197 ASP A Protein A 5 FT #SUB 175 201 GLY B 171 197 ASP A Protein B 4 FT #SUB 178 204 ARG B 169 195 LEU A Protein S 3 FT #SUB 178 204 ARG B 170 196 GLY A Protein S 2 FT #SUB 178 204 ARG B 171 197 ASP A Protein S 2 FT #SUB 178 204 ARG B 178 204 ARG A Protein S 15 FT #SUB 186 212 LYS B 227 255 ASP A Protein S 2 FT #SUB 204 230 VAL B 226 254 GLU A Protein S 3 FT #SUB 204 230 VAL B 227 255 ASP A Protein S 1 FT #SUB 226 254 GLU B 204 230 VAL A Protein B 3 FT #SUB 227 255 ASP B 186 212 LYS A Protein B 2 FT #SUB 3 28 GLN B 68 94 LYS C Protein S 1 FT #SUB 261 289 GLY B 88 114 GLY C Protein B 1 FT #HET 17 42 GLY B 4 3 SCN B B 1 FT #HET 24 49 ILE B 3 1 SCN B S 3 FT #HET 35 61 ARG B 4 3 SCN B S 3 FT #HET 43 69 CYS B 6 302 SFR B A 2 FT #HET 44 70 SER B 6 302 SFR B A 15 FT #HET 68 94 LYS B 5 4 SCN B B 1 FT #HET 69 95 MET B 5 4 SCN B A 6 FT #HET 70 96 THR B 5 4 SCN B A 8 FT #HET 79 105 TRP B 6 302 SFR B S 14 FT #HET 104 130 SER B 6 302 SFR B S 5 FT #HET 106 132 ASN B 6 302 SFR B S 4 FT #HET 111 137 LYS B 5 4 SCN B S 1 FT #HET 140 166 GLU B 6 302 SFR B S 1 FT #HET 144 170 ASN B 6 302 SFR B S 6 FT #HET 162 188 LYS B 3 1 SCN B A 5 FT #HET 165 191 ARG B 3 1 SCN B S 5 FT #HET 166 192 LYS B 3 1 SCN B S 2 FT #HET 190 216 THR B 6 302 SFR B S 1 FT #HET 208 234 LYS B 6 302 SFR B S 1 FT #HET 209 235 THR B 6 302 SFR B A 6 FT #HET 210 236 GLY B 6 302 SFR B B 5 FT #HET 211 237 ALA B 6 302 SFR B B 8 CC SEQUENCE 262 AA (ATOM); CC VQQVQKKLAA LEKQSGGRLG VALINTADNS QVLYRADERF AMCSTSKVMT AAAVLKQSET CC HDGILQQKMT IKKADLTNWN PVTEKYVGNT MTLAELSAAT LQYSDNTAMN KLLAHLGGPG CC NVTAFARSIG DTTFRLDRKE PELNTAIPGD ERDTTSPLAM AKSLRKLTLG DALAGPQRAQ CC LVDWLKGNTT GGQSIRAGLP AHWVVGDKTG ACDYGTTNDI AVIWPEDRAP LVLVTYFTQP CC QQDAKWRKDV LAAAAKIVTE GK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VQQVQKKLAALEKQSGGRLGVALINTADNSQVLYRADERFAMCSTSKVMT CC ATOM VQQVQKKLAALEKQSGGRLGVALINTADNSQVLYRADERFAMCSTSKVMT CC ************************************************** CC SEQRES AAAVLKQSETHDGILQQKMTIKKADLTNWNPVTEKYVGNTMTLAELSAAT CC ATOM AAAVLKQSETHDGILQQKMTIKKADLTNWNPVTEKYVGNTMTLAELSAAT CC ************************************************** CC SEQRES LQYSDNTAMNKLLAHLGGPGNVTAFARSIGDTTFRLDRKEPELNTAIPGD CC ATOM LQYSDNTAMNKLLAHLGGPGNVTAFARSIGDTTFRLDRKEPELNTAIPGD CC ************************************************** CC SEQRES ERDTTSPLAMAKSLRKLTLGDALAGPQRAQLVDWLKGNTTGGQSIRAGLP CC ATOM ERDTTSPLAMAKSLRKLTLGDALAGPQRAQLVDWLKGNTTGGQSIRAGLP CC ************************************************** CC SEQRES AHWVVGDKTGACDYGTTNDIAVIWPEDRAPLVLVTYFTQPQQDAKWRKDV CC ATOM AHWVVGDKTGACDYGTTNDIAVIWPEDRAPLVLVTYFTQPQQDAKWRKDV CC ************************************************** CC SEQRES LAAAAKIVTEGK CC ATOM LAAAAKIVTEGK CC ************ SQ SEQUENCE 262 AA; MW; CN; VQQVQKKLAA LEKQSGGRLG VALINTADNS QVLYRADERF AMCSTSKVMT AAAVLKQSET HDGILQQKMT IKKADLTNWN PVTEKYVGNT MTLAELSAAT LQYSDNTAMN KLLAHLGGPG NVTAFARSIG DTTFRLDRKE PELNTAIPGD ERDTTSPLAM AKSLRKLTLG DALAGPQRAQ LVDWLKGNTT GGQSIRAGLP AHWVVGDKTG ACDYGTTNDI AVIWPEDRAP LVLVTYFTQP QQDAKWRKDV LAAAAKIVTE GK // ID 3BFFC STANDARD; PRT; 262 AA. DT CONVERTED FROM PDB (SEQRES) 3BFF DE Class A beta-lactamase Sed1 OS Citrobacter sedlakii CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.900 CC R-Factor 0.189 FT #SUB 73 99 LYS C 102 128 GLN A Protein S 4 FT #SUB 77 103 THR C 86 112 TYR A Protein B 1 FT #SUB 78 104 ASN C 85 111 LYS A Protein S 2 FT #SUB 78 104 ASN C 86 112 TYR A Protein A 7 FT #SUB 245 273 LYS C 72 98 LYS A Protein S 1 FT #SUB 246 274 TRP C 89 115 ASN A Protein S 2 FT #SUB 68 94 LYS C 3 28 GLN B Protein S 1 FT #SUB 88 114 GLY C 261 289 GLY B Protein B 1 FT #SUB 169 195 LEU C 178 204 ARG D Protein B 3 FT #SUB 170 196 GLY C 178 204 ARG D Protein B 2 FT #SUB 171 197 ASP C 174 200 ALA D Protein S 4 FT #SUB 171 197 ASP C 175 201 GLY D Protein S 6 FT #SUB 171 197 ASP C 178 204 ARG D Protein S 3 FT #SUB 174 200 ALA C 171 197 ASP D Protein A 5 FT #SUB 175 201 GLY C 171 197 ASP D Protein B 6 FT #SUB 178 204 ARG C 169 195 LEU D Protein S 2 FT #SUB 178 204 ARG C 170 196 GLY D Protein S 2 FT #SUB 178 204 ARG C 171 197 ASP D Protein S 3 FT #SUB 178 204 ARG C 178 204 ARG D Protein S 12 FT #SUB 186 212 LYS C 227 255 ASP D Protein S 2 FT #SUB 204 230 VAL C 226 254 GLU D Protein S 3 FT #SUB 226 254 GLU C 204 230 VAL D Protein B 3 FT #SUB 227 255 ASP C 186 212 LYS D Protein B 2 FT #SUB 227 255 ASP C 204 230 VAL D Protein B 1 FT #HET 43 69 CYS C 9 303 SFR C A 3 FT #HET 44 70 SER C 9 303 SFR C A 15 FT #HET 47 73 LYS C 9 303 SFR C S 1 FT #HET 68 94 LYS C 8 1 FPM C B 1 FT #HET 69 95 MET C 8 1 FPM C A 15 FT #HET 70 96 THR C 8 1 FPM C A 12 FT #HET 79 105 TRP C 9 303 SFR C S 4 FT #HET 104 130 SER C 9 303 SFR C S 6 FT #HET 106 132 ASN C 9 303 SFR C S 8 FT #HET 111 137 LYS C 8 1 FPM C S 3 FT #HET 114 140 ALA C 8 1 FPM C A 6 FT #HET 115 141 HIS C 8 1 FPM C B 6 FT #HET 140 166 GLU C 9 303 SFR C S 3 FT #HET 144 170 ASN C 9 303 SFR C S 1 FT #HET 148 174 PRO C 7 5 SCN C B 1 FT #HET 149 175 GLY C 7 5 SCN C B 2 FT #HET 150 176 ASP C 7 5 SCN C A 5 FT #HET 190 216 THR C 9 303 SFR C S 3 FT #HET 208 234 LYS C 9 303 SFR C S 1 FT #HET 209 235 THR C 9 303 SFR C A 7 FT #HET 210 236 GLY C 9 303 SFR C B 6 FT #HET 211 237 ALA C 9 303 SFR C B 8 CC SEQUENCE 262 AA (ATOM); CC VQQVQKKLAA LEKQSGGRLG VALINTADNS QVLYRADERF AMCSTSKVMT AAAVLKQSET CC HDGILQQKMT IKKADLTNWN PVTEKYVGNT MTLAELSAAT LQYSDNTAMN KLLAHLGGPG CC NVTAFARSIG DTTFRLDRKE PELNTAIPGD ERDTTSPLAM AKSLRKLTLG DALAGPQRAQ CC LVDWLKGNTT GGQSIRAGLP AHWVVGDKTG ACDYGTTNDI AVIWPEDRAP LVLVTYFTQP CC QQDAKWRKDV LAAAAKIVTE GK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VQQVQKKLAALEKQSGGRLGVALINTADNSQVLYRADERFAMCSTSKVMT CC ATOM VQQVQKKLAALEKQSGGRLGVALINTADNSQVLYRADERFAMCSTSKVMT CC ************************************************** CC SEQRES AAAVLKQSETHDGILQQKMTIKKADLTNWNPVTEKYVGNTMTLAELSAAT CC ATOM AAAVLKQSETHDGILQQKMTIKKADLTNWNPVTEKYVGNTMTLAELSAAT CC ************************************************** CC SEQRES LQYSDNTAMNKLLAHLGGPGNVTAFARSIGDTTFRLDRKEPELNTAIPGD CC ATOM LQYSDNTAMNKLLAHLGGPGNVTAFARSIGDTTFRLDRKEPELNTAIPGD CC ************************************************** CC SEQRES ERDTTSPLAMAKSLRKLTLGDALAGPQRAQLVDWLKGNTTGGQSIRAGLP CC ATOM ERDTTSPLAMAKSLRKLTLGDALAGPQRAQLVDWLKGNTTGGQSIRAGLP CC ************************************************** CC SEQRES AHWVVGDKTGACDYGTTNDIAVIWPEDRAPLVLVTYFTQPQQDAKWRKDV CC ATOM AHWVVGDKTGACDYGTTNDIAVIWPEDRAPLVLVTYFTQPQQDAKWRKDV CC ************************************************** CC SEQRES LAAAAKIVTEGK CC ATOM LAAAAKIVTEGK CC ************ SQ SEQUENCE 262 AA; MW; CN; VQQVQKKLAA LEKQSGGRLG VALINTADNS QVLYRADERF AMCSTSKVMT AAAVLKQSET HDGILQQKMT IKKADLTNWN PVTEKYVGNT MTLAELSAAT LQYSDNTAMN KLLAHLGGPG NVTAFARSIG DTTFRLDRKE PELNTAIPGD ERDTTSPLAM AKSLRKLTLG DALAGPQRAQ LVDWLKGNTT GGQSIRAGLP AHWVVGDKTG ACDYGTTNDI AVIWPEDRAP LVLVTYFTQP QQDAKWRKDV LAAAAKIVTE GK // ID 3BFFD STANDARD; PRT; 262 AA. DT CONVERTED FROM PDB (SEQRES) 3BFF DE Class A beta-lactamase Sed1 OS Citrobacter sedlakii CC EXPDTA X-RAY DIFFRACTION CC RESOLU 1.900 CC R-Factor 0.189 FT #SUB 169 195 LEU D 178 204 ARG C Protein B 2 FT #SUB 170 196 GLY D 178 204 ARG C Protein B 2 FT #SUB 171 197 ASP D 174 200 ALA C Protein S 5 FT #SUB 171 197 ASP D 175 201 GLY C Protein S 6 FT #SUB 171 197 ASP D 178 204 ARG C Protein S 3 FT #SUB 174 200 ALA D 171 197 ASP C Protein A 4 FT #SUB 175 201 GLY D 171 197 ASP C Protein B 6 FT #SUB 178 204 ARG D 169 195 LEU C Protein S 3 FT #SUB 178 204 ARG D 170 196 GLY C Protein S 2 FT #SUB 178 204 ARG D 171 197 ASP C Protein S 3 FT #SUB 178 204 ARG D 178 204 ARG C Protein S 12 FT #SUB 186 212 LYS D 227 255 ASP C Protein S 2 FT #SUB 204 230 VAL D 226 254 GLU C Protein S 3 FT #SUB 204 230 VAL D 227 255 ASP C Protein S 1 FT #SUB 226 254 GLU D 204 230 VAL C Protein B 3 FT #SUB 227 255 ASP D 186 212 LYS C Protein B 2 FT #HET 43 69 CYS D 11 304 SFR D A 2 FT #HET 44 70 SER D 11 304 SFR D A 15 FT #HET 47 73 LYS D 11 304 SFR D S 1 FT #HET 79 105 TRP D 11 304 SFR D S 9 FT #HET 104 130 SER D 11 304 SFR D S 8 FT #HET 106 132 ASN D 11 304 SFR D S 6 FT #HET 140 166 GLU D 11 304 SFR D S 1 FT #HET 144 170 ASN D 11 304 SFR D S 3 FT #HET 190 216 THR D 11 304 SFR D S 1 FT #HET 208 234 LYS D 11 304 SFR D S 1 FT #HET 209 235 THR D 11 304 SFR D A 6 FT #HET 210 236 GLY D 11 304 SFR D B 3 FT #HET 211 237 ALA D 11 304 SFR D A 7 FT #HET 228 256 ARG D 10 6 SCN D S 3 FT #HET 261 289 GLY D 10 6 SCN D B 2 CC SEQUENCE 262 AA (ATOM); CC VQQVQKKLAA LEKQSGGRLG VALINTADNS QVLYRADERF AMCSTSKVMT AAAVLKQSET CC HDGILQQKMT IKKADLTNWN PVTEKYVGNT MTLAELSAAT LQYSDNTAMN KLLAHLGGPG CC NVTAFARSIG DTTFRLDRKE PELNTAIPGD ERDTTSPLAM AKSLRKLTLG DALAGPQRAQ CC LVDWLKGNTT GGQSIRAGLP AHWVVGDKTG ACDYGTTNDI AVIWPEDRAP LVLVTYFTQP CC QQDAKWRKDV LAAAAKIVTE GK CC !---- CC ALIGNMENT OF SEQRES AND ATOMRES CC SEQRES VQQVQKKLAALEKQSGGRLGVALINTADNSQVLYRADERFAMCSTSKVMT CC ATOM VQQVQKKLAALEKQSGGRLGVALINTADNSQVLYRADERFAMCSTSKVMT CC ************************************************** CC SEQRES AAAVLKQSETHDGILQQKMTIKKADLTNWNPVTEKYVGNTMTLAELSAAT CC ATOM AAAVLKQSETHDGILQQKMTIKKADLTNWNPVTEKYVGNTMTLAELSAAT CC ************************************************** CC SEQRES LQYSDNTAMNKLLAHLGGPGNVTAFARSIGDTTFRLDRKEPELNTAIPGD CC ATOM LQYSDNTAMNKLLAHLGGPGNVTAFARSIGDTTFRLDRKEPELNTAIPGD CC ************************************************** CC SEQRES ERDTTSPLAMAKSLRKLTLGDALAGPQRAQLVDWLKGNTTGGQSIRAGLP CC ATOM ERDTTSPLAMAKSLRKLTLGDALAGPQRAQLVDWLKGNTTGGQSIRAGLP CC ************************************************** CC SEQRES AHWVVGDKTGACDYGTTNDIAVIWPEDRAPLVLVTYFTQPQQDAKWRKDV CC ATOM AHWVVGDKTGACDYGTTNDIAVIWPEDRAPLVLVTYFTQPQQDAKWRKDV CC ************************************************** CC SEQRES LAAAAKIVTEGK CC ATOM LAAAAKIVTEGK CC ************ SQ SEQUENCE 262 AA; MW; CN; VQQVQKKLAA LEKQSGGRLG VALINTADNS QVLYRADERF AMCSTSKVMT AAAVLKQSET HDGILQQKMT IKKADLTNWN PVTEKYVGNT MTLAELSAAT LQYSDNTAMN KLLAHLGGPG NVTAFARSIG DTTFRLDRKE PELNTAIPGD ERDTTSPLAM AKSLRKLTLG DALAGPQRAQ LVDWLKGNTT GGQSIRAGLP AHWVVGDKTG ACDYGTTNDI AVIWPEDRAP LVLVTYFTQP QQDAKWRKDV LAAAAKIVTE GK //