3V4T
E. cloacae C115D MURA liganded with UNAG
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0003824 | molecular_function | catalytic activity |
| A | 0005737 | cellular_component | cytoplasm |
| A | 0008360 | biological_process | regulation of cell shape |
| A | 0008760 | molecular_function | UDP-N-acetylglucosamine 1-carboxyvinyltransferase activity |
| A | 0009252 | biological_process | peptidoglycan biosynthetic process |
| A | 0016740 | molecular_function | transferase activity |
| A | 0016765 | molecular_function | transferase activity, transferring alkyl or aryl (other than methyl) groups |
| A | 0019277 | biological_process | UDP-N-acetylgalactosamine biosynthetic process |
| A | 0051301 | biological_process | cell division |
| A | 0071555 | biological_process | cell wall organization |
| B | 0003824 | molecular_function | catalytic activity |
| B | 0005737 | cellular_component | cytoplasm |
| B | 0008360 | biological_process | regulation of cell shape |
| B | 0008760 | molecular_function | UDP-N-acetylglucosamine 1-carboxyvinyltransferase activity |
| B | 0009252 | biological_process | peptidoglycan biosynthetic process |
| B | 0016740 | molecular_function | transferase activity |
| B | 0016765 | molecular_function | transferase activity, transferring alkyl or aryl (other than methyl) groups |
| B | 0019277 | biological_process | UDP-N-acetylgalactosamine biosynthetic process |
| B | 0051301 | biological_process | cell division |
| B | 0071555 | biological_process | cell wall organization |
| C | 0003824 | molecular_function | catalytic activity |
| C | 0005737 | cellular_component | cytoplasm |
| C | 0008360 | biological_process | regulation of cell shape |
| C | 0008760 | molecular_function | UDP-N-acetylglucosamine 1-carboxyvinyltransferase activity |
| C | 0009252 | biological_process | peptidoglycan biosynthetic process |
| C | 0016740 | molecular_function | transferase activity |
| C | 0016765 | molecular_function | transferase activity, transferring alkyl or aryl (other than methyl) groups |
| C | 0019277 | biological_process | UDP-N-acetylgalactosamine biosynthetic process |
| C | 0051301 | biological_process | cell division |
| C | 0071555 | biological_process | cell wall organization |
| D | 0003824 | molecular_function | catalytic activity |
| D | 0005737 | cellular_component | cytoplasm |
| D | 0008360 | biological_process | regulation of cell shape |
| D | 0008760 | molecular_function | UDP-N-acetylglucosamine 1-carboxyvinyltransferase activity |
| D | 0009252 | biological_process | peptidoglycan biosynthetic process |
| D | 0016740 | molecular_function | transferase activity |
| D | 0016765 | molecular_function | transferase activity, transferring alkyl or aryl (other than methyl) groups |
| D | 0019277 | biological_process | UDP-N-acetylgalactosamine biosynthetic process |
| D | 0051301 | biological_process | cell division |
| D | 0071555 | biological_process | cell wall organization |
| E | 0003824 | molecular_function | catalytic activity |
| E | 0005737 | cellular_component | cytoplasm |
| E | 0008360 | biological_process | regulation of cell shape |
| E | 0008760 | molecular_function | UDP-N-acetylglucosamine 1-carboxyvinyltransferase activity |
| E | 0009252 | biological_process | peptidoglycan biosynthetic process |
| E | 0016740 | molecular_function | transferase activity |
| E | 0016765 | molecular_function | transferase activity, transferring alkyl or aryl (other than methyl) groups |
| E | 0019277 | biological_process | UDP-N-acetylgalactosamine biosynthetic process |
| E | 0051301 | biological_process | cell division |
| E | 0071555 | biological_process | cell wall organization |
| F | 0003824 | molecular_function | catalytic activity |
| F | 0005737 | cellular_component | cytoplasm |
| F | 0008360 | biological_process | regulation of cell shape |
| F | 0008760 | molecular_function | UDP-N-acetylglucosamine 1-carboxyvinyltransferase activity |
| F | 0009252 | biological_process | peptidoglycan biosynthetic process |
| F | 0016740 | molecular_function | transferase activity |
| F | 0016765 | molecular_function | transferase activity, transferring alkyl or aryl (other than methyl) groups |
| F | 0019277 | biological_process | UDP-N-acetylgalactosamine biosynthetic process |
| F | 0051301 | biological_process | cell division |
| F | 0071555 | biological_process | cell wall organization |
| G | 0003824 | molecular_function | catalytic activity |
| G | 0005737 | cellular_component | cytoplasm |
| G | 0008360 | biological_process | regulation of cell shape |
| G | 0008760 | molecular_function | UDP-N-acetylglucosamine 1-carboxyvinyltransferase activity |
| G | 0009252 | biological_process | peptidoglycan biosynthetic process |
| G | 0016740 | molecular_function | transferase activity |
| G | 0016765 | molecular_function | transferase activity, transferring alkyl or aryl (other than methyl) groups |
| G | 0019277 | biological_process | UDP-N-acetylgalactosamine biosynthetic process |
| G | 0051301 | biological_process | cell division |
| G | 0071555 | biological_process | cell wall organization |
| H | 0003824 | molecular_function | catalytic activity |
| H | 0005737 | cellular_component | cytoplasm |
| H | 0008360 | biological_process | regulation of cell shape |
| H | 0008760 | molecular_function | UDP-N-acetylglucosamine 1-carboxyvinyltransferase activity |
| H | 0009252 | biological_process | peptidoglycan biosynthetic process |
| H | 0016740 | molecular_function | transferase activity |
| H | 0016765 | molecular_function | transferase activity, transferring alkyl or aryl (other than methyl) groups |
| H | 0019277 | biological_process | UDP-N-acetylgalactosamine biosynthetic process |
| H | 0051301 | biological_process | cell division |
| H | 0071555 | biological_process | cell wall organization |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE UD1 A 501 |
| Chain | Residue |
| A | ASN23 |
| A | SER162 |
| A | VAL163 |
| A | GLY164 |
| A | THR304 |
| A | ASP305 |
| A | ILE327 |
| A | PHE328 |
| A | EDO506 |
| A | EDO507 |
| A | HOH608 |
| A | TRP95 |
| A | HOH626 |
| A | HOH653 |
| A | ARG120 |
| A | PRO121 |
| A | VAL122 |
| A | ASP123 |
| A | LEU124 |
| A | HIS125 |
| A | LYS160 |
| site_id | AC2 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE ACT A 502 |
| Chain | Residue |
| A | TYR84 |
| A | VAL87 |
| A | SER110 |
| A | LEU111 |
| A | PRO112 |
| A | GLY113 |
| site_id | AC3 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE ACT A 503 |
| Chain | Residue |
| A | ARG267 |
| A | ILE273 |
| A | GLU274 |
| A | THR275 |
| site_id | AC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE ACT A 504 |
| Chain | Residue |
| A | ALA363 |
| A | GLN364 |
| A | THR386 |
| A | VAL388 |
| D | GLU140 |
| site_id | AC5 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE ACT A 505 |
| Chain | Residue |
| A | ASN350 |
| C | GLU348 |
| site_id | AC6 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO A 506 |
| Chain | Residue |
| A | ARG91 |
| A | HIS125 |
| A | GLY164 |
| A | UD1501 |
| A | HOH653 |
| site_id | AC7 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO A 507 |
| Chain | Residue |
| A | VAL161 |
| A | GLU188 |
| A | PRO298 |
| A | UD1501 |
| A | HOH604 |
| A | HOH663 |
| site_id | AC8 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO A 508 |
| Chain | Residue |
| A | ASP260 |
| A | LEU263 |
| A | ARG267 |
| B | HIS155 |
| site_id | AC9 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO A 509 |
| Chain | Residue |
| A | ASP193 |
| A | GLN255 |
| site_id | BC1 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE UD1 B 501 |
| Chain | Residue |
| B | ASN23 |
| B | TRP95 |
| B | ARG120 |
| B | PRO121 |
| B | VAL122 |
| B | ASP123 |
| B | LEU124 |
| B | HIS125 |
| B | LYS160 |
| B | SER162 |
| B | VAL163 |
| B | GLY164 |
| B | THR304 |
| B | ASP305 |
| B | ILE327 |
| B | PHE328 |
| B | ACT502 |
| B | EDO503 |
| B | EDO504 |
| B | HOH602 |
| B | HOH608 |
| B | HOH613 |
| site_id | BC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE ACT B 502 |
| Chain | Residue |
| B | THR326 |
| B | ILE327 |
| B | GLU329 |
| B | UD1501 |
| site_id | BC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO B 503 |
| Chain | Residue |
| B | TRP95 |
| B | ARG120 |
| B | HIS125 |
| B | GLY164 |
| B | UD1501 |
| B | HOH602 |
| site_id | BC4 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO B 504 |
| Chain | Residue |
| B | LYS22 |
| B | LEU26 |
| B | ASP49 |
| B | MET90 |
| B | ARG91 |
| B | ALA92 |
| B | ARG397 |
| B | UD1501 |
| site_id | BC5 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO B 505 |
| Chain | Residue |
| B | GLN255 |
| B | HOH626 |
| B | VAL192 |
| B | ASP193 |
| B | ASN196 |
| B | TYR226 |
| site_id | BC6 |
| Number of Residues | 23 |
| Details | BINDING SITE FOR RESIDUE UD1 C 501 |
| Chain | Residue |
| C | ASN23 |
| C | TRP95 |
| C | ARG120 |
| C | PRO121 |
| C | VAL122 |
| C | ASP123 |
| C | LEU124 |
| C | HIS125 |
| C | SER162 |
| C | VAL163 |
| C | GLY164 |
| C | THR304 |
| C | ASP305 |
| C | ILE327 |
| C | PHE328 |
| C | EDO504 |
| C | HOH604 |
| C | HOH605 |
| C | HOH608 |
| C | HOH616 |
| C | HOH626 |
| C | HOH629 |
| C | HOH634 |
| site_id | BC7 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE ACT C 502 |
| Chain | Residue |
| C | ASP257 |
| C | GLY276 |
| C | GLU277 |
| site_id | BC8 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE ACT C 503 |
| Chain | Residue |
| C | LYS160 |
| C | VAL161 |
| C | ILE327 |
| C | HOH615 |
| C | HOH634 |
| site_id | BC9 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO C 504 |
| Chain | Residue |
| C | ALA92 |
| C | TRP95 |
| C | ARG120 |
| C | HIS125 |
| C | GLY164 |
| C | UD1501 |
| C | HOH604 |
| site_id | CC1 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO C 505 |
| Chain | Residue |
| C | THR52 |
| C | LEU86 |
| site_id | CC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO C 506 |
| Chain | Residue |
| C | VAL192 |
| C | ASP193 |
| C | ASN196 |
| C | GLN255 |
| site_id | CC3 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO C 507 |
| Chain | Residue |
| C | ARG252 |
| C | ASN253 |
| site_id | CC4 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE UD1 D 501 |
| Chain | Residue |
| D | ASN23 |
| D | TRP95 |
| D | ARG120 |
| D | PRO121 |
| D | VAL122 |
| D | ASP123 |
| D | LEU124 |
| D | HIS125 |
| D | LYS160 |
| D | SER162 |
| D | VAL163 |
| D | GLY164 |
| D | THR304 |
| D | ASP305 |
| D | ILE327 |
| D | PHE328 |
| D | EDO504 |
| D | EDO506 |
| D | EDO510 |
| D | HOH602 |
| D | HOH625 |
| D | HOH659 |
| site_id | CC5 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE ACT D 502 |
| Chain | Residue |
| D | ASN412 |
| site_id | CC6 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE ACT D 503 |
| Chain | Residue |
| D | GLN108 |
| D | TYR142 |
| D | LYS144 |
| site_id | CC7 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO D 504 |
| Chain | Residue |
| D | ARG91 |
| D | ALA92 |
| D | TRP95 |
| D | HIS125 |
| D | GLY164 |
| D | UD1501 |
| D | EDO510 |
| D | HOH602 |
| site_id | CC8 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO D 505 |
| Chain | Residue |
| D | LYS22 |
| D | LEU26 |
| D | ASP49 |
| D | ARG91 |
| D | ALA92 |
| D | LEU370 |
| D | ARG397 |
| D | EDO510 |
| site_id | CC9 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO D 506 |
| Chain | Residue |
| D | VAL161 |
| D | GLU188 |
| D | PRO298 |
| D | ILE327 |
| D | UD1501 |
| D | HOH624 |
| site_id | DC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO D 507 |
| Chain | Residue |
| D | ILE244 |
| D | GLU358 |
| D | ILE382 |
| H | ACT505 |
| site_id | DC2 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO D 508 |
| Chain | Residue |
| D | ARG150 |
| D | LEU175 |
| D | GLU177 |
| site_id | DC3 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE EDO D 509 |
| Chain | Residue |
| A | ARG340 |
| D | TYR84 |
| D | VAL87 |
| D | LYS88 |
| D | SER110 |
| D | LEU111 |
| D | PRO112 |
| D | GLY113 |
| D | HOH637 |
| site_id | DC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO D 510 |
| Chain | Residue |
| D | ARG120 |
| D | LEU370 |
| D | UD1501 |
| D | EDO504 |
| D | EDO505 |
| site_id | DC5 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE UD1 E 501 |
| Chain | Residue |
| E | ASN23 |
| E | TRP95 |
| E | ARG120 |
| E | PRO121 |
| E | VAL122 |
| E | ASP123 |
| E | LEU124 |
| E | HIS125 |
| E | LYS160 |
| E | SER162 |
| E | VAL163 |
| E | GLY164 |
| E | THR304 |
| E | ASP305 |
| E | ILE327 |
| E | PHE328 |
| E | ACT502 |
| E | EDO509 |
| E | HOH603 |
| E | HOH608 |
| E | HOH618 |
| E | HOH644 |
| site_id | DC6 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE ACT E 502 |
| Chain | Residue |
| E | LYS22 |
| E | ARG120 |
| E | LEU370 |
| E | UD1501 |
| site_id | DC7 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE ACT E 503 |
| Chain | Residue |
| E | GLN7 |
| E | PRO9 |
| site_id | DC8 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE ACT E 504 |
| Chain | Residue |
| E | GLU65 |
| site_id | DC9 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO E 505 |
| Chain | Residue |
| A | ASN412 |
| E | ARG11 |
| E | GLN13 |
| site_id | EC1 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO E 506 |
| Chain | Residue |
| E | VAL316 |
| E | GLU358 |
| E | LYS359 |
| E | LEU360 |
| E | ILE382 |
| site_id | EC2 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO E 507 |
| Chain | Residue |
| A | ARG11 |
| A | SER245 |
| E | HIS285 |
| E | GLY286 |
| E | LYS287 |
| site_id | EC3 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE EDO E 508 |
| Chain | Residue |
| E | ASP123 |
| site_id | EC4 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO E 509 |
| Chain | Residue |
| E | ARG91 |
| E | TRP95 |
| E | ARG120 |
| E | HIS125 |
| E | GLY164 |
| E | UD1501 |
| E | HOH608 |
| site_id | EC5 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE EDO E 510 |
| Chain | Residue |
| E | ASP404 |
| site_id | EC6 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO E 511 |
| Chain | Residue |
| E | PRO38 |
| E | GLY224 |
| H | GLU277 |
| H | ASP278 |
| site_id | EC7 |
| Number of Residues | 23 |
| Details | BINDING SITE FOR RESIDUE UD1 F 501 |
| Chain | Residue |
| F | ASN23 |
| F | TRP95 |
| F | ARG120 |
| F | PRO121 |
| F | VAL122 |
| F | ASP123 |
| F | LEU124 |
| F | HIS125 |
| F | LYS160 |
| F | SER162 |
| F | VAL163 |
| F | GLY164 |
| F | THR304 |
| F | ASP305 |
| F | ILE327 |
| F | PHE328 |
| F | EDO505 |
| F | HOH606 |
| F | HOH612 |
| F | HOH622 |
| F | HOH625 |
| F | HOH634 |
| F | HOH635 |
| site_id | EC8 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE ACT F 503 |
| Chain | Residue |
| F | PHE328 |
| F | GLU329 |
| F | ARG331 |
| F | PHE332 |
| F | SER349 |
| F | ASN350 |
| site_id | EC9 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE ACT F 504 |
| Chain | Residue |
| F | ARG288 |
| F | GLU318 |
| site_id | FC1 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO F 505 |
| Chain | Residue |
| F | ARG91 |
| F | ILE94 |
| F | TRP95 |
| F | ARG120 |
| F | HIS125 |
| F | GLY164 |
| F | UD1501 |
| F | HOH606 |
| site_id | FC2 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO F 506 |
| Chain | Residue |
| E | HIS155 |
| F | ALA264 |
| F | ARG267 |
| site_id | FC3 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE EDO F 507 |
| Chain | Residue |
| F | HOH644 |
| site_id | FC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO F 508 |
| Chain | Residue |
| E | ARG295 |
| F | LYS160 |
| F | VAL161 |
| F | ILE327 |
| F | HOH656 |
| site_id | FC5 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO F 509 |
| Chain | Residue |
| E | ALA261 |
| E | ALA264 |
| E | LYS265 |
| E | GLU268 |
| E | HOH636 |
| F | VAL157 |
| F | ASP159 |
| site_id | FC6 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE UD1 G 501 |
| Chain | Residue |
| G | ASN23 |
| G | TRP95 |
| G | ARG120 |
| G | PRO121 |
| G | VAL122 |
| G | ASP123 |
| G | LEU124 |
| G | LYS160 |
| G | SER162 |
| G | VAL163 |
| G | GLY164 |
| G | THR304 |
| G | ASP305 |
| G | ILE327 |
| G | PHE328 |
| G | ARG331 |
| G | EDO502 |
| G | HOH604 |
| G | HOH614 |
| G | HOH643 |
| G | HOH646 |
| G | HOH660 |
| site_id | FC7 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO G 502 |
| Chain | Residue |
| G | ARG91 |
| G | TRP95 |
| G | HIS125 |
| G | GLY164 |
| G | UD1501 |
| G | HOH643 |
| site_id | FC8 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO G 503 |
| Chain | Residue |
| G | THR210 |
| G | ASP211 |
| H | GLY209 |
| site_id | FC9 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO G 504 |
| Chain | Residue |
| G | LEU111 |
| G | PRO121 |
| G | VAL122 |
| site_id | GC1 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE EDO G 505 |
| Chain | Residue |
| G | ASN196 |
| site_id | GC2 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO G 506 |
| Chain | Residue |
| G | ARG252 |
| G | SER281 |
| site_id | GC3 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO G 507 |
| Chain | Residue |
| G | ASP260 |
| G | ALA264 |
| G | ARG267 |
| site_id | GC4 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO G 508 |
| Chain | Residue |
| G | GLN7 |
| G | GLY8 |
| G | PRO9 |
| G | THR10 |
| G | ASN412 |
| site_id | GC5 |
| Number of Residues | 17 |
| Details | BINDING SITE FOR RESIDUE UD1 H 501 |
| Chain | Residue |
| H | ASN23 |
| H | TRP95 |
| H | ARG120 |
| H | PRO121 |
| H | VAL122 |
| H | ASP123 |
| H | LEU124 |
| H | LYS160 |
| H | SER162 |
| H | VAL163 |
| H | GLY164 |
| H | THR304 |
| H | ASP305 |
| H | ILE327 |
| H | ACT503 |
| H | HOH606 |
| H | HOH607 |
| site_id | GC6 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE ACT H 502 |
| Chain | Residue |
| H | GLY207 |
| H | GLN208 |
| H | HOH639 |
| site_id | GC7 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE ACT H 503 |
| Chain | Residue |
| H | ARG91 |
| H | TRP95 |
| H | HIS125 |
| H | GLY164 |
| H | UD1501 |
| H | HOH606 |
| site_id | GC8 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE ACT H 504 |
| Chain | Residue |
| H | LYS63 |
| H | GLU65 |
| H | TRP71 |
| site_id | GC9 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE ACT H 505 |
| Chain | Residue |
| D | THR10 |
| D | ARG11 |
| D | EDO507 |
| H | HIS285 |
| H | GLY286 |
| H | LYS287 |
| site_id | HC1 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE ACT H 506 |
| Chain | Residue |
| H | PRO38 |
| H | VAL225 |
| site_id | HC2 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO H 507 |
| Chain | Residue |
| H | TYR84 |
| H | VAL87 |
| H | LYS88 |
| H | SER110 |
| H | LEU111 |
| H | PRO112 |
| H | GLY113 |
| H | HOH655 |
| site_id | HC3 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO H 508 |
| Chain | Residue |
| H | PRO27 |
| H | ALA31 |
| H | TRP95 |
| H | PRO99 |
| H | VAL167 |
| H | THR168 |
| H | SER171 |
| H | HOH628 |
| site_id | HC4 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO H 509 |
| Chain | Residue |
| H | ILE126 |
| H | HOH644 |
| site_id | HC5 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO H 510 |
| Chain | Residue |
| H | THR58 |
| H | HOH610 |
| site_id | HC6 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO H 511 |
| Chain | Residue |
| H | LYS88 |
| H | THR89 |
| H | ARG91 |
| H | ASP115 |
| H | ARG397 |
| H | HOH641 |
| H | HOH655 |
| site_id | HC7 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE EDO H 512 |
| Chain | Residue |
| H | SER19 |
| H | GLY20 |
| H | LYS22 |
| H | PRO45 |
| H | ASP231 |
| H | GLU234 |
| H | GLY398 |
| H | TYR399 |
| H | GLU400 |
| H | HOH633 |
| site_id | HC8 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO H 513 |
| Chain | Residue |
| H | PRO9 |
| H | ASN412 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 8 |
| Details | ACT_SITE: Proton donor => ECO:0000269|PubMed:20392080, ECO:0000269|PubMed:22378791, ECO:0007744|PDB:3LTH |
| Chain | Residue | Details |
| A | ASP115 | |
| B | ASP115 | |
| C | ASP115 | |
| D | ASP115 | |
| E | ASP115 | |
| F | ASP115 | |
| G | ASP115 | |
| H | ASP115 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 8 |
| Details | BINDING: BINDING => ECO:0000305|PubMed:22378791, ECO:0007744|PDB:3SWQ |
| Chain | Residue | Details |
| B | LYS22 | |
| C | LYS22 | |
| D | LYS22 | |
| A | LYS22 | |
| E | LYS22 | |
| F | LYS22 | |
| G | LYS22 | |
| H | LYS22 |
| site_id | SWS_FT_FI3 |
| Number of Residues | 8 |
| Details | BINDING: BINDING => ECO:0000255|HAMAP-Rule:MF_00111 |
| Chain | Residue | Details |
| A | ARG91 | |
| B | ARG91 | |
| C | ARG91 | |
| D | ARG91 | |
| E | ARG91 | |
| F | ARG91 | |
| G | ARG91 | |
| H | ARG91 |
| site_id | SWS_FT_FI4 |
| Number of Residues | 24 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:20392080, ECO:0000269|PubMed:22378791, ECO:0007744|PDB:3LTH, ECO:0007744|PDB:3SWQ |
| Chain | Residue | Details |
| C | ILE327 | |
| D | ARG120 | |
| D | ASP305 | |
| D | ILE327 | |
| E | ARG120 | |
| E | ASP305 | |
| E | ILE327 | |
| F | ARG120 | |
| F | ASP305 | |
| F | ILE327 | |
| G | ARG120 | |
| G | ASP305 | |
| G | ILE327 | |
| H | ARG120 | |
| H | ASP305 | |
| H | ILE327 | |
| A | ARG120 | |
| A | ASP305 | |
| A | ILE327 | |
| B | ARG120 | |
| B | ASP305 | |
| B | ILE327 | |
| C | ARG120 | |
| C | ASP305 |
| site_id | SWS_FT_FI5 |
| Number of Residues | 8 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:22378791, ECO:0007744|PDB:3SWQ |
| Chain | Residue | Details |
| A | LYS160 | |
| B | LYS160 | |
| C | LYS160 | |
| D | LYS160 | |
| E | LYS160 | |
| F | LYS160 | |
| G | LYS160 | |
| H | LYS160 |
| site_id | SWS_FT_FI6 |
| Number of Residues | 8 |
| Details | MOD_RES: 2-(S-cysteinyl)pyruvic acid O-phosphothioketal => ECO:0000269|PubMed:22378791 |
| Chain | Residue | Details |
| A | ASP115 | |
| B | ASP115 | |
| C | ASP115 | |
| D | ASP115 | |
| E | ASP115 | |
| F | ASP115 | |
| G | ASP115 | |
| H | ASP115 |
Catalytic Information from CSA
| site_id | MCSA1 |
| Number of Residues | 6 |
| Details | M-CSA 369 |
| Chain | Residue | Details |
| A | LYS22 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| A | ASN23 | electrostatic stabiliser, hydrogen bond donor |
| A | ASP115 | activator, hydrogen bond acceptor, hydrogen bond donor, nucleofuge, nucleophile, proton acceptor, proton donor, proton relay |
| A | ARG120 | electrostatic stabiliser, proton acceptor, proton donor |
| A | ASP305 | activator, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| A | ARG397 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| site_id | MCSA2 |
| Number of Residues | 6 |
| Details | M-CSA 369 |
| Chain | Residue | Details |
| B | LYS22 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| B | ASN23 | electrostatic stabiliser, hydrogen bond donor |
| B | ASP115 | activator, hydrogen bond acceptor, hydrogen bond donor, nucleofuge, nucleophile, proton acceptor, proton donor, proton relay |
| B | ARG120 | electrostatic stabiliser, proton acceptor, proton donor |
| B | ASP305 | activator, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| B | ARG397 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| site_id | MCSA3 |
| Number of Residues | 6 |
| Details | M-CSA 369 |
| Chain | Residue | Details |
| C | LYS22 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| C | ASN23 | electrostatic stabiliser, hydrogen bond donor |
| C | ASP115 | activator, hydrogen bond acceptor, hydrogen bond donor, nucleofuge, nucleophile, proton acceptor, proton donor, proton relay |
| C | ARG120 | electrostatic stabiliser, proton acceptor, proton donor |
| C | ASP305 | activator, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| C | ARG397 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| site_id | MCSA4 |
| Number of Residues | 6 |
| Details | M-CSA 369 |
| Chain | Residue | Details |
| D | LYS22 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| D | ASN23 | electrostatic stabiliser, hydrogen bond donor |
| D | ASP115 | activator, hydrogen bond acceptor, hydrogen bond donor, nucleofuge, nucleophile, proton acceptor, proton donor, proton relay |
| D | ARG120 | electrostatic stabiliser, proton acceptor, proton donor |
| D | ASP305 | activator, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| D | ARG397 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| site_id | MCSA5 |
| Number of Residues | 6 |
| Details | M-CSA 369 |
| Chain | Residue | Details |
| E | LYS22 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| E | ASN23 | electrostatic stabiliser, hydrogen bond donor |
| E | ASP115 | activator, hydrogen bond acceptor, hydrogen bond donor, nucleofuge, nucleophile, proton acceptor, proton donor, proton relay |
| E | ARG120 | electrostatic stabiliser, proton acceptor, proton donor |
| E | ASP305 | activator, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| E | ARG397 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| site_id | MCSA6 |
| Number of Residues | 6 |
| Details | M-CSA 369 |
| Chain | Residue | Details |
| F | LYS22 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| F | ASN23 | electrostatic stabiliser, hydrogen bond donor |
| F | ASP115 | activator, hydrogen bond acceptor, hydrogen bond donor, nucleofuge, nucleophile, proton acceptor, proton donor, proton relay |
| F | ARG120 | electrostatic stabiliser, proton acceptor, proton donor |
| F | ASP305 | activator, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| F | ARG397 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| site_id | MCSA7 |
| Number of Residues | 6 |
| Details | M-CSA 369 |
| Chain | Residue | Details |
| G | LYS22 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| G | ASN23 | electrostatic stabiliser, hydrogen bond donor |
| G | ASP115 | activator, hydrogen bond acceptor, hydrogen bond donor, nucleofuge, nucleophile, proton acceptor, proton donor, proton relay |
| G | ARG120 | electrostatic stabiliser, proton acceptor, proton donor |
| G | ASP305 | activator, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| G | ARG397 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| site_id | MCSA8 |
| Number of Residues | 6 |
| Details | M-CSA 369 |
| Chain | Residue | Details |
| H | LYS22 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
| H | ASN23 | electrostatic stabiliser, hydrogen bond donor |
| H | ASP115 | activator, hydrogen bond acceptor, hydrogen bond donor, nucleofuge, nucleophile, proton acceptor, proton donor, proton relay |
| H | ARG120 | electrostatic stabiliser, proton acceptor, proton donor |
| H | ASP305 | activator, hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor |
| H | ARG397 | electrostatic stabiliser, hydrogen bond donor, proton acceptor, proton donor |
