DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Thiamine pyrophosphokinase 1
Ligand Name
1-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-3-(2-{[HYDROXY(PHOSPHONOOXY)PHOSPHORYL]OXY}ETHYL)-2-METHYLPYRIDINIUM
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ZHKSTKOYQKNDSJ-UHFFFAOYSA-O
SMILES
Cc1c(ccc[n+]1Cc2cnc(nc2N)C)CCOP(=O)(O)OP(=O)(O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 2F17
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Color Legend
Unassigned regionsLigand / hetero atomse2f17A1e2f17A2e2f17B1e2f17B2
ECOD domains from experimental PDB structures interacting with ligand DB04768
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q9R0M5DB04768PYI2f17e2f17A1A:159-243
Q9R0M5DB04768PYI2f17e2f17A2A:-9-158
Q9R0M5DB04768PYI2f17e2f17B1B:159-243
Q9R0M5DB04768PYI2f17e2f17B2B:1-158