5HUQ
A tethered niacin-derived pincer complex with a nickel-carbon bond in lactate racemase
Replaces: 4YNSFunctional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0016853 | molecular_function | isomerase activity |
| A | 0046872 | molecular_function | metal ion binding |
| A | 0050043 | molecular_function | lactate racemase activity |
| B | 0016853 | molecular_function | isomerase activity |
| B | 0046872 | molecular_function | metal ion binding |
| B | 0050043 | molecular_function | lactate racemase activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 13 |
| Details | binding site for residue 4EY A 501 |
| Chain | Residue |
| A | SER71 |
| A | LYS184 |
| A | PRO188 |
| A | GLY189 |
| A | SO4502 |
| A | ASP72 |
| A | THR74 |
| A | ARG75 |
| A | ALA104 |
| A | PHE107 |
| A | HIS108 |
| A | SER180 |
| A | GLY181 |
| site_id | AC2 |
| Number of Residues | 5 |
| Details | binding site for residue SO4 A 502 |
| Chain | Residue |
| A | ARG75 |
| A | HIS108 |
| A | GLN295 |
| A | LYS298 |
| A | 4EY501 |
| site_id | AC3 |
| Number of Residues | 2 |
| Details | binding site for residue SO4 A 503 |
| Chain | Residue |
| A | HIS108 |
| A | ARG109 |
| site_id | AC4 |
| Number of Residues | 1 |
| Details | binding site for residue SO4 A 504 |
| Chain | Residue |
| A | ARG109 |
| site_id | AC5 |
| Number of Residues | 1 |
| Details | binding site for residue SO4 A 505 |
| Chain | Residue |
| A | ARG320 |
| site_id | AC6 |
| Number of Residues | 2 |
| Details | binding site for residue SO4 A 506 |
| Chain | Residue |
| A | LYS10 |
| A | ARG320 |
| site_id | AC7 |
| Number of Residues | 2 |
| Details | binding site for residue SO4 A 507 |
| Chain | Residue |
| A | ARG11 |
| A | THR12 |
| site_id | AC8 |
| Number of Residues | 2 |
| Details | binding site for residue SO4 A 508 |
| Chain | Residue |
| A | SER38 |
| A | GLU39 |
| site_id | AC9 |
| Number of Residues | 3 |
| Details | binding site for residue SO4 A 509 |
| Chain | Residue |
| A | GLU203 |
| A | PRO349 |
| A | ARG350 |
| site_id | AD1 |
| Number of Residues | 4 |
| Details | binding site for residue SO4 A 510 |
| Chain | Residue |
| A | GLY407 |
| A | GLN408 |
| A | ALA409 |
| A | ALA410 |
| site_id | AD2 |
| Number of Residues | 2 |
| Details | binding site for residue SO4 A 511 |
| Chain | Residue |
| A | ARG98 |
| B | ARG98 |
| site_id | AD3 |
| Number of Residues | 3 |
| Details | binding site for residue SO4 A 512 |
| Chain | Residue |
| A | MET132 |
| A | ASP137 |
| B | ASP137 |
| site_id | AD4 |
| Number of Residues | 4 |
| Details | binding site for residue NI B 501 |
| Chain | Residue |
| B | PRO188 |
| B | HIS200 |
| B | 4EY502 |
| B | SO4503 |
| site_id | AD5 |
| Number of Residues | 8 |
| Details | binding site for residue SO4 B 503 |
| Chain | Residue |
| B | ARG75 |
| B | HIS108 |
| B | HIS174 |
| B | TYR294 |
| B | GLN295 |
| B | LYS298 |
| B | NI501 |
| B | 4EY502 |
| site_id | AD6 |
| Number of Residues | 5 |
| Details | binding site for residue SO4 B 504 |
| Chain | Residue |
| B | ARG109 |
| B | GLN291 |
| B | ASN292 |
| B | ASP321 |
| B | HIS323 |
| site_id | AD7 |
| Number of Residues | 1 |
| Details | binding site for residue SO4 B 505 |
| Chain | Residue |
| B | ARG320 |
| site_id | AD8 |
| Number of Residues | 2 |
| Details | binding site for residue SO4 B 506 |
| Chain | Residue |
| B | GLY121 |
| B | GLU122 |
| site_id | AD9 |
| Number of Residues | 3 |
| Details | binding site for residue SO4 B 507 |
| Chain | Residue |
| B | SER38 |
| B | GLU39 |
| B | LYS246 |
| site_id | AE1 |
| Number of Residues | 1 |
| Details | binding site for residue SO4 B 508 |
| Chain | Residue |
| B | ARG350 |
| site_id | AE2 |
| Number of Residues | 3 |
| Details | binding site for residue SO4 B 509 |
| Chain | Residue |
| B | GLU203 |
| B | PRO349 |
| B | ARG350 |
| site_id | AE3 |
| Number of Residues | 2 |
| Details | binding site for residue SO4 B 510 |
| Chain | Residue |
| B | SER207 |
| B | PRO208 |
| site_id | AE4 |
| Number of Residues | 1 |
| Details | binding site for residue SO4 B 511 |
| Chain | Residue |
| B | HIS217 |
| site_id | AE5 |
| Number of Residues | 6 |
| Details | binding site for residue SO4 B 512 |
| Chain | Residue |
| B | ARG211 |
| B | VAL423 |
| B | LYS424 |
| B | ALA425 |
| B | SER426 |
| B | SO4513 |
| site_id | AE6 |
| Number of Residues | 4 |
| Details | binding site for residue SO4 B 513 |
| Chain | Residue |
| A | LYS143 |
| B | LYS424 |
| B | TRP427 |
| B | SO4512 |
| site_id | AE7 |
| Number of Residues | 2 |
| Details | binding site for residue SO4 B 514 |
| Chain | Residue |
| B | HIS371 |
| B | ARG405 |
| site_id | AE8 |
| Number of Residues | 23 |
| Details | binding site for Di-peptide 4EY B 502 and LYS B 184 |
| Chain | Residue |
| B | PRO188 |
| B | GLY189 |
| B | HIS200 |
| B | TYR294 |
| B | NI501 |
| B | SO4503 |
| B | SER71 |
| B | ASP72 |
| B | THR74 |
| B | ARG75 |
| B | ALA104 |
| B | THR105 |
| B | PHE107 |
| B | HIS108 |
| B | PHE170 |
| B | HIS174 |
| B | SER180 |
| B | GLY181 |
| B | GLY182 |
| B | ARG183 |
| B | SER185 |
| B | VAL186 |
| B | LEU187 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 4 |
| Details | Active site: {"description":"Proton donor/acceptor","evidences":[{"source":"PubMed","id":"26138974","evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 8 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"26138974","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI3 |
| Number of Residues | 2 |
| Details | Binding site: {"description":"covalent","evidences":[{"source":"PubMed","id":"26138974","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"27114550","evidenceCode":"ECO:0000269"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI4 |
| Number of Residues | 4 |
| Details | Binding site: {"evidences":[{"source":"PubMed","id":"26138974","evidenceCode":"ECO:0000305"}]} |
| Chain | Residue | Details |
