DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Pyruvate kinase PKLR
Ligand Name
N-{[4-(3,4-dihydroxybenzene-1-sulfonyl)phenyl]methyl}-3,4-dihydroxybenzene-1-sulfonamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ZBQJJGXTFOWIRF-UHFFFAOYSA-N
SMILES
c1cc(ccc1CNS(=O)(=O)c2ccc(c(c2)O)O)S(=O)(=O)c3ccc(c(c3)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 7FRX
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Color Legend
Unassigned regionsLigand / hetero atomse7frxA1e7frxA2e7frxB1e7frxB2e7frxC1e7frxC2e7frxD1e7frxD2e7frxE1e7frxE2e7frxF1e7frxF2e7frxG1e7frxG2e7frxH1e7frxH2
ECOD domains from experimental PDB structures interacting with ligand O88
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P30613n/aO887frxe7frxA1A:23-408
P30613n/aO887frxe7frxA2A:409-543
P30613n/aO887frxe7frxB1B:10-408
P30613n/aO887frxe7frxB2B:409-543
P30613n/aO887frxe7frxC1C:19-408
P30613n/aO887frxe7frxC2C:409-543
P30613n/aO887frxe7frxD1D:409-543
P30613n/aO887frxe7frxD2D:21-408
P30613n/aO887frxe7frxE1E:409-543
P30613n/aO887frxe7frxE2E:23-408
P30613n/aO887frxe7frxF1F:409-543
P30613n/aO887frxe7frxF2F:11-408
P30613n/aO887frxe7frxG1G:409-543
P30613n/aO887frxe7frxG2G:23-408
P30613n/aO887frxe7frxH1H:21-408
P30613n/aO887frxe7frxH2H:409-543