DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Pyruvate kinase
Ligand Name
(2R)-2-hydroxy-2-{2-[4-(3-hydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonyl)piperazin-1-yl]-2-oxoethyl}butanedioic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BDGXYHKLUUUHLU-XMMPIXPASA-N
SMILES
c1ccc2c(c1)C(=O)c3cc(c(cc3C2=O)S(=O)(=O)N4CCN(CC4)C(=O)CC(CC(=O)O)(C(=O)O)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: 5SCJ
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse5scjA1e5scjA2e5scjB1e5scjB2e5scjC1e5scjC2e5scjD1e5scjD2e5scjE1e5scjE2e5scjF1e5scjF2e5scjG1e5scjG2e5scjH1e5scjH2
ECOD domains from experimental PDB structures interacting with ligand I9K
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q16716n/aI9K5scje5scjA1A:23-408
Q16716n/aI9K5scje5scjC1C:19-408
Q16716n/aI9K5scje5scjF2F:11-408
Q16716n/aI9K5scje5scjG1G:23-408