Attributes
UniProt ID
Protein Name
Pyruvate kinase PKLR
Ligand Name
N-{[4-(3,4-dihydroxybenzene-1-sulfonyl)phenyl]methyl}-N-(3,4-dihydroxyphenyl)-3,4-dihydroxybenzene-1-sulfonamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IMBHNAVYXWHQLJ-UHFFFAOYSA-N
SMILES
c1cc(ccc1CN(c2ccc(c(c2)O)O)S(=O)(=O)c3ccc(c(c3)O)O)S(=O)(=O)c4ccc(c(c4)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 7FS7
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Color Legend
Unassigned regionsLigand / hetero atomse7fs7A1e7fs7A2e7fs7B1e7fs7B2e7fs7C1e7fs7C2e7fs7D1e7fs7D2e7fs7E1e7fs7E2e7fs7F1e7fs7F2e7fs7G1e7fs7G2e7fs7H1e7fs7H2
ECOD domains from experimental PDB structures interacting with ligand OAT
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P30613 | n/a | OAT | 7fs7 | e7fs7B1 | B:409-543 |
| P30613 | n/a | OAT | 7fs7 | e7fs7B2 | B:10-408 |
| P30613 | n/a | OAT | 7fs7 | e7fs7D1 | D:21-408 |
| P30613 | n/a | OAT | 7fs7 | e7fs7D2 | D:409-543 |
| P30613 | n/a | OAT | 7fs7 | e7fs7E1 | E:409-543 |
| P30613 | n/a | OAT | 7fs7 | e7fs7E2 | E:23-408 |
| P30613 | n/a | OAT | 7fs7 | e7fs7F1 | F:11-408 |
| P30613 | n/a | OAT | 7fs7 | e7fs7F2 | F:409-543 |
| P30613 | n/a | OAT | 7fs7 | e7fs7G1 | G:409-543 |
| P30613 | n/a | OAT | 7fs7 | e7fs7G2 | G:23-408 |
| P30613 | n/a | OAT | 7fs7 | e7fs7H1 | H:21-408 |
| P30613 | n/a | OAT | 7fs7 | e7fs7H2 | H:409-543 |