4H2H
Crystal structure of an enolase (mandalate racemase subgroup, target EFI-502101) from Pelagibaca bermudensis htcc2601, with bound mg and l-4-hydroxyproline betaine (betonicine)
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0000287 | molecular_function | magnesium ion binding |
| A | 0006579 | biological_process | amino-acid betaine catabolic process |
| A | 0016853 | molecular_function | isomerase activity |
| A | 0016854 | molecular_function | racemase and epimerase activity |
| A | 0016855 | molecular_function | racemase and epimerase activity, acting on amino acids and derivatives |
| A | 0036361 | molecular_function | racemase activity, acting on amino acids and derivatives |
| A | 0046872 | molecular_function | metal ion binding |
| B | 0000287 | molecular_function | magnesium ion binding |
| B | 0006579 | biological_process | amino-acid betaine catabolic process |
| B | 0016853 | molecular_function | isomerase activity |
| B | 0016854 | molecular_function | racemase and epimerase activity |
| B | 0016855 | molecular_function | racemase and epimerase activity, acting on amino acids and derivatives |
| B | 0036361 | molecular_function | racemase activity, acting on amino acids and derivatives |
| B | 0046872 | molecular_function | metal ion binding |
| C | 0000287 | molecular_function | magnesium ion binding |
| C | 0006579 | biological_process | amino-acid betaine catabolic process |
| C | 0016853 | molecular_function | isomerase activity |
| C | 0016854 | molecular_function | racemase and epimerase activity |
| C | 0016855 | molecular_function | racemase and epimerase activity, acting on amino acids and derivatives |
| C | 0036361 | molecular_function | racemase activity, acting on amino acids and derivatives |
| C | 0046872 | molecular_function | metal ion binding |
| D | 0000287 | molecular_function | magnesium ion binding |
| D | 0006579 | biological_process | amino-acid betaine catabolic process |
| D | 0016853 | molecular_function | isomerase activity |
| D | 0016854 | molecular_function | racemase and epimerase activity |
| D | 0016855 | molecular_function | racemase and epimerase activity, acting on amino acids and derivatives |
| D | 0036361 | molecular_function | racemase activity, acting on amino acids and derivatives |
| D | 0046872 | molecular_function | metal ion binding |
| E | 0000287 | molecular_function | magnesium ion binding |
| E | 0006579 | biological_process | amino-acid betaine catabolic process |
| E | 0016853 | molecular_function | isomerase activity |
| E | 0016854 | molecular_function | racemase and epimerase activity |
| E | 0016855 | molecular_function | racemase and epimerase activity, acting on amino acids and derivatives |
| E | 0036361 | molecular_function | racemase activity, acting on amino acids and derivatives |
| E | 0046872 | molecular_function | metal ion binding |
| F | 0000287 | molecular_function | magnesium ion binding |
| F | 0006579 | biological_process | amino-acid betaine catabolic process |
| F | 0016853 | molecular_function | isomerase activity |
| F | 0016854 | molecular_function | racemase and epimerase activity |
| F | 0016855 | molecular_function | racemase and epimerase activity, acting on amino acids and derivatives |
| F | 0036361 | molecular_function | racemase activity, acting on amino acids and derivatives |
| F | 0046872 | molecular_function | metal ion binding |
| G | 0000287 | molecular_function | magnesium ion binding |
| G | 0006579 | biological_process | amino-acid betaine catabolic process |
| G | 0016853 | molecular_function | isomerase activity |
| G | 0016854 | molecular_function | racemase and epimerase activity |
| G | 0016855 | molecular_function | racemase and epimerase activity, acting on amino acids and derivatives |
| G | 0036361 | molecular_function | racemase activity, acting on amino acids and derivatives |
| G | 0046872 | molecular_function | metal ion binding |
| H | 0000287 | molecular_function | magnesium ion binding |
| H | 0006579 | biological_process | amino-acid betaine catabolic process |
| H | 0016853 | molecular_function | isomerase activity |
| H | 0016854 | molecular_function | racemase and epimerase activity |
| H | 0016855 | molecular_function | racemase and epimerase activity, acting on amino acids and derivatives |
| H | 0036361 | molecular_function | racemase activity, acting on amino acids and derivatives |
| H | 0046872 | molecular_function | metal ion binding |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG A 401 |
| Chain | Residue |
| A | GLN161 |
| A | ASP193 |
| A | GLU218 |
| A | ASP241 |
| A | 0XW403 |
| A | HOH550 |
| site_id | AC2 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE NI A 402 |
| Chain | Residue |
| C | HOH507 |
| E | HIS235 |
| H | HIS235 |
| A | HIS235 |
| C | HIS235 |
| C | HOH505 |
| site_id | AC3 |
| Number of Residues | 13 |
| Details | BINDING SITE FOR RESIDUE 0XW A 403 |
| Chain | Residue |
| A | TYR20 |
| A | TYR56 |
| A | TYR134 |
| A | GLN161 |
| A | LYS163 |
| A | ASP193 |
| A | ASN195 |
| A | GLU218 |
| A | ASP241 |
| A | LYS265 |
| A | ALA294 |
| A | TRP320 |
| A | MG401 |
| site_id | AC4 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE IOD A 404 |
| Chain | Residue |
| A | GLY185 |
| A | GLY187 |
| C | HOH549 |
| site_id | AC5 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE IOD A 405 |
| Chain | Residue |
| A | SER246 |
| A | LEU247 |
| A | ASN248 |
| site_id | AC6 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD A 406 |
| Chain | Residue |
| A | ARG314 |
| site_id | AC7 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD A 407 |
| Chain | Residue |
| A | HOH663 |
| site_id | AC8 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD A 409 |
| Chain | Residue |
| A | LYS36 |
| site_id | AC9 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD A 410 |
| Chain | Residue |
| A | HIS329 |
| site_id | BC1 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG B 401 |
| Chain | Residue |
| B | GLN161 |
| B | ASP193 |
| B | GLU218 |
| B | ASP241 |
| B | 0XW403 |
| B | HOH551 |
| site_id | BC2 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE NI B 402 |
| Chain | Residue |
| B | HIS235 |
| D | HIS235 |
| D | HOH528 |
| F | HIS235 |
| F | HOH510 |
| G | HIS235 |
| site_id | BC3 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE 0XW B 403 |
| Chain | Residue |
| B | TYR20 |
| B | TYR56 |
| B | TYR134 |
| B | SER136 |
| B | GLN161 |
| B | LYS163 |
| B | ASP193 |
| B | ASN195 |
| B | GLU218 |
| B | ASP241 |
| B | LYS265 |
| B | ALA294 |
| B | TRP320 |
| B | MG401 |
| site_id | BC4 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE IOD B 404 |
| Chain | Residue |
| B | GLY185 |
| B | GLY187 |
| F | HOH566 |
| site_id | BC5 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD B 405 |
| Chain | Residue |
| B | ARG314 |
| site_id | BC6 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD B 407 |
| Chain | Residue |
| B | ARG88 |
| site_id | BC7 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD B 408 |
| Chain | Residue |
| B | HOH787 |
| site_id | BC8 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD B 409 |
| Chain | Residue |
| B | HIS329 |
| site_id | BC9 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG C 401 |
| Chain | Residue |
| C | GLN161 |
| C | ASP193 |
| C | GLU218 |
| C | ASP241 |
| C | 0XW402 |
| C | HOH514 |
| site_id | CC1 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE 0XW C 402 |
| Chain | Residue |
| C | TYR20 |
| C | VAL52 |
| C | TYR56 |
| C | TYR134 |
| C | GLN161 |
| C | LYS163 |
| C | ASP193 |
| C | ASN195 |
| C | GLU218 |
| C | ASP241 |
| C | LYS265 |
| C | ALA294 |
| C | TRP320 |
| C | MG401 |
| site_id | CC2 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE MPD C 403 |
| Chain | Residue |
| C | LYS178 |
| C | GLU181 |
| F | ALA146 |
| F | LYS178 |
| F | GLU181 |
| F | ALA182 |
| F | HOH663 |
| site_id | CC3 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE IOD C 404 |
| Chain | Residue |
| C | GLU141 |
| C | ARG167 |
| site_id | CC4 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD C 405 |
| Chain | Residue |
| C | HOH709 |
| site_id | CC5 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD C 406 |
| Chain | Residue |
| C | ARG314 |
| site_id | CC6 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD C 407 |
| Chain | Residue |
| C | ARG147 |
| site_id | CC7 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE IOD C 410 |
| Chain | Residue |
| C | GLY185 |
| C | GLY187 |
| H | HOH591 |
| site_id | CC8 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD C 412 |
| Chain | Residue |
| C | GLU141 |
| site_id | CC9 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD C 413 |
| Chain | Residue |
| C | HIS329 |
| site_id | DC1 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG D 401 |
| Chain | Residue |
| D | GLN161 |
| D | ASP193 |
| D | GLU218 |
| D | ASP241 |
| D | 0XW402 |
| D | HOH524 |
| site_id | DC2 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE 0XW D 402 |
| Chain | Residue |
| D | TYR20 |
| D | VAL52 |
| D | TYR56 |
| D | TYR134 |
| D | SER136 |
| D | GLN161 |
| D | LYS163 |
| D | ASP193 |
| D | ASN195 |
| D | GLU218 |
| D | ASP241 |
| D | LYS265 |
| D | ALA294 |
| D | TRP320 |
| D | MG401 |
| site_id | DC3 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE MPD D 403 |
| Chain | Residue |
| C | PHE224 |
| C | GLU228 |
| D | PHE224 |
| D | HOH623 |
| D | HOH631 |
| site_id | DC4 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD D 404 |
| Chain | Residue |
| D | ARG167 |
| site_id | DC5 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE IOD D 405 |
| Chain | Residue |
| B | HOH609 |
| D | GLY185 |
| D | GLY187 |
| site_id | DC6 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD D 406 |
| Chain | Residue |
| D | HOH638 |
| site_id | DC7 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD D 407 |
| Chain | Residue |
| D | ARG314 |
| site_id | DC8 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD D 408 |
| Chain | Residue |
| D | ARG88 |
| site_id | DC9 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE IOD D 409 |
| Chain | Residue |
| D | PRO19 |
| D | TYR20 |
| D | ARG21 |
| D | GLY138 |
| D | HOH713 |
| site_id | EC1 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD D 410 |
| Chain | Residue |
| D | ASN17 |
| site_id | EC2 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE IOD D 411 |
| Chain | Residue |
| D | ILE44 |
| D | LYS113 |
| site_id | EC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG E 401 |
| Chain | Residue |
| E | GLN161 |
| E | ASP193 |
| E | GLU218 |
| E | ASP241 |
| E | 0XW402 |
| E | HOH738 |
| site_id | EC4 |
| Number of Residues | 12 |
| Details | BINDING SITE FOR RESIDUE 0XW E 402 |
| Chain | Residue |
| E | VAL52 |
| E | TYR56 |
| E | TYR134 |
| E | SER136 |
| E | GLN161 |
| E | LYS163 |
| E | ASP193 |
| E | GLU218 |
| E | ASP241 |
| E | LYS265 |
| E | ALA294 |
| E | MG401 |
| site_id | EC5 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MPD E 403 |
| Chain | Residue |
| E | PHE224 |
| E | GLU228 |
| E | HOH616 |
| E | HOH649 |
| F | PHE224 |
| F | GLU228 |
| site_id | EC6 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD E 404 |
| Chain | Residue |
| E | ARG167 |
| site_id | EC7 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD E 405 |
| Chain | Residue |
| E | ARG314 |
| site_id | EC8 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD E 406 |
| Chain | Residue |
| E | HOH693 |
| site_id | EC9 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD E 407 |
| Chain | Residue |
| E | ARG88 |
| site_id | FC1 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD E 408 |
| Chain | Residue |
| E | VAL139 |
| site_id | FC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE IOD E 409 |
| Chain | Residue |
| E | ILE44 |
| E | LYS113 |
| E | HOH710 |
| E | HOH735 |
| site_id | FC3 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE IOD E 410 |
| Chain | Residue |
| A | HOH602 |
| E | GLY185 |
| E | GLY187 |
| site_id | FC4 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG F 401 |
| Chain | Residue |
| F | GLN161 |
| F | ASP193 |
| F | GLU218 |
| F | ASP241 |
| F | 0XW402 |
| F | HOH571 |
| site_id | FC5 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE 0XW F 402 |
| Chain | Residue |
| F | TYR20 |
| F | VAL52 |
| F | TYR56 |
| F | TYR134 |
| F | GLN161 |
| F | LYS163 |
| F | ASP193 |
| F | ASN195 |
| F | GLU218 |
| F | ASP241 |
| F | LYS265 |
| F | ALA294 |
| F | TRP320 |
| F | MG401 |
| site_id | FC6 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD F 403 |
| Chain | Residue |
| F | HOH667 |
| site_id | FC7 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD F 404 |
| Chain | Residue |
| F | ARG167 |
| site_id | FC8 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE IOD F 406 |
| Chain | Residue |
| F | GLY185 |
| F | GLY187 |
| site_id | FC9 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD F 407 |
| Chain | Residue |
| F | ARG314 |
| site_id | GC1 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE IOD F 410 |
| Chain | Residue |
| F | MET140 |
| F | GLU141 |
| site_id | GC2 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG G 401 |
| Chain | Residue |
| G | GLN161 |
| G | ASP193 |
| G | GLU218 |
| G | ASP241 |
| G | 0XW402 |
| G | HOH517 |
| site_id | GC3 |
| Number of Residues | 13 |
| Details | BINDING SITE FOR RESIDUE 0XW G 402 |
| Chain | Residue |
| G | VAL52 |
| G | TYR56 |
| G | TYR134 |
| G | GLN161 |
| G | LYS163 |
| G | ASP193 |
| G | ASN195 |
| G | GLU218 |
| G | ASP241 |
| G | LYS265 |
| G | ALA294 |
| G | TRP320 |
| G | MG401 |
| site_id | GC4 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD G 403 |
| Chain | Residue |
| G | ARG314 |
| site_id | GC5 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD G 404 |
| Chain | Residue |
| G | HOH614 |
| site_id | GC6 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD G 405 |
| Chain | Residue |
| G | ARG167 |
| site_id | GC7 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD G 406 |
| Chain | Residue |
| G | HIS329 |
| site_id | GC8 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE IOD G 407 |
| Chain | Residue |
| G | ILE44 |
| G | LYS113 |
| site_id | GC9 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD G 408 |
| Chain | Residue |
| G | ARG88 |
| site_id | HC1 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE IOD G 409 |
| Chain | Residue |
| D | HOH641 |
| G | GLY185 |
| G | GLY187 |
| site_id | HC2 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD G 410 |
| Chain | Residue |
| G | GLU141 |
| site_id | HC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG H 401 |
| Chain | Residue |
| H | GLN161 |
| H | ASP193 |
| H | GLU218 |
| H | ASP241 |
| H | 0XW402 |
| H | HOH515 |
| site_id | HC4 |
| Number of Residues | 13 |
| Details | BINDING SITE FOR RESIDUE 0XW H 402 |
| Chain | Residue |
| H | TYR20 |
| H | VAL52 |
| H | TYR56 |
| H | GLN161 |
| H | LYS163 |
| H | ASP193 |
| H | ASN195 |
| H | GLU218 |
| H | ASP241 |
| H | LYS265 |
| H | ALA294 |
| H | TRP320 |
| H | MG401 |
| site_id | HC5 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD H 403 |
| Chain | Residue |
| H | ARG314 |
| site_id | HC6 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD H 404 |
| Chain | Residue |
| H | HOH645 |
| site_id | HC7 |
| Number of Residues | 1 |
| Details | BINDING SITE FOR RESIDUE IOD H 405 |
| Chain | Residue |
| H | ARG167 |
| site_id | HC8 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE IOD H 406 |
| Chain | Residue |
| H | MET140 |
| H | GLU141 |
| site_id | HC9 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE IOD H 408 |
| Chain | Residue |
| E | HOH591 |
| H | GLY185 |
| H | GLY187 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 16 |
| Details | ACT_SITE: Proton donor/acceptor => ECO:0000250 |
| Chain | Residue | Details |
| A | LYS163 | |
| E | LYS265 | |
| F | LYS163 | |
| F | LYS265 | |
| G | LYS163 | |
| G | LYS265 | |
| H | LYS163 | |
| H | LYS265 | |
| A | LYS265 | |
| B | LYS163 | |
| B | LYS265 | |
| C | LYS163 | |
| C | LYS265 | |
| D | LYS163 | |
| D | LYS265 | |
| E | LYS163 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 48 |
| Details | BINDING: |
| Chain | Residue | Details |
| A | TYR56 | |
| B | GLU218 | |
| B | ASP241 | |
| B | ALA294 | |
| C | TYR56 | |
| C | GLN161 | |
| C | ASP193 | |
| C | GLU218 | |
| C | ASP241 | |
| C | ALA294 | |
| D | TYR56 | |
| A | GLN161 | |
| D | GLN161 | |
| D | ASP193 | |
| D | GLU218 | |
| D | ASP241 | |
| D | ALA294 | |
| E | TYR56 | |
| E | GLN161 | |
| E | ASP193 | |
| E | GLU218 | |
| E | ASP241 | |
| A | ASP193 | |
| E | ALA294 | |
| F | TYR56 | |
| F | GLN161 | |
| F | ASP193 | |
| F | GLU218 | |
| F | ASP241 | |
| F | ALA294 | |
| G | TYR56 | |
| G | GLN161 | |
| G | ASP193 | |
| A | GLU218 | |
| G | GLU218 | |
| G | ASP241 | |
| G | ALA294 | |
| H | TYR56 | |
| H | GLN161 | |
| H | ASP193 | |
| H | GLU218 | |
| H | ASP241 | |
| H | ALA294 | |
| A | ASP241 | |
| A | ALA294 | |
| B | TYR56 | |
| B | GLN161 | |
| B | ASP193 |
Catalytic Information from CSA
| site_id | MCSA1 |
| Number of Residues | 6 |
| Details | M-CSA 940 |
| Chain | Residue | Details |
| A | LYS163 | proton shuttle (general acid/base) |
| A | ASP193 | metal ligand |
| A | GLU218 | metal ligand |
| A | ASP241 | metal ligand |
| A | LYS265 | proton shuttle (general acid/base) |
| A | TRP320 | electrostatic stabiliser |
| site_id | MCSA2 |
| Number of Residues | 6 |
| Details | M-CSA 940 |
| Chain | Residue | Details |
| B | LYS163 | proton shuttle (general acid/base) |
| B | ASP193 | metal ligand |
| B | GLU218 | metal ligand |
| B | ASP241 | metal ligand |
| B | LYS265 | proton shuttle (general acid/base) |
| B | TRP320 | electrostatic stabiliser |
| site_id | MCSA3 |
| Number of Residues | 6 |
| Details | M-CSA 940 |
| Chain | Residue | Details |
| C | LYS163 | proton shuttle (general acid/base) |
| C | ASP193 | metal ligand |
| C | GLU218 | metal ligand |
| C | ASP241 | metal ligand |
| C | LYS265 | proton shuttle (general acid/base) |
| C | TRP320 | electrostatic stabiliser |
| site_id | MCSA4 |
| Number of Residues | 6 |
| Details | M-CSA 940 |
| Chain | Residue | Details |
| D | LYS163 | proton shuttle (general acid/base) |
| D | ASP193 | metal ligand |
| D | GLU218 | metal ligand |
| D | ASP241 | metal ligand |
| D | LYS265 | proton shuttle (general acid/base) |
| D | TRP320 | electrostatic stabiliser |
| site_id | MCSA5 |
| Number of Residues | 6 |
| Details | M-CSA 940 |
| Chain | Residue | Details |
| E | LYS163 | proton shuttle (general acid/base) |
| E | ASP193 | metal ligand |
| E | GLU218 | metal ligand |
| E | ASP241 | metal ligand |
| E | LYS265 | proton shuttle (general acid/base) |
| E | TRP320 | electrostatic stabiliser |
| site_id | MCSA6 |
| Number of Residues | 6 |
| Details | M-CSA 940 |
| Chain | Residue | Details |
| F | LYS163 | proton shuttle (general acid/base) |
| F | ASP193 | metal ligand |
| F | GLU218 | metal ligand |
| F | ASP241 | metal ligand |
| F | LYS265 | proton shuttle (general acid/base) |
| F | TRP320 | electrostatic stabiliser |
| site_id | MCSA7 |
| Number of Residues | 6 |
| Details | M-CSA 940 |
| Chain | Residue | Details |
| G | LYS163 | proton shuttle (general acid/base) |
| G | ASP193 | metal ligand |
| G | GLU218 | metal ligand |
| G | ASP241 | metal ligand |
| G | LYS265 | proton shuttle (general acid/base) |
| G | TRP320 | electrostatic stabiliser |
| site_id | MCSA8 |
| Number of Residues | 6 |
| Details | M-CSA 940 |
| Chain | Residue | Details |
| H | LYS163 | proton shuttle (general acid/base) |
| H | ASP193 | metal ligand |
| H | GLU218 | metal ligand |
| H | ASP241 | metal ligand |
| H | LYS265 | proton shuttle (general acid/base) |
| H | TRP320 | electrostatic stabiliser |
