DrugDomain logoDrugDomain

Attributes

UniProt ID
O34664
Protein Name
Thiamine pyrophosphokinase
Ligand Name
3-(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-METHYL-THIAZOL-3-IUM
DrugBank ID
DB00152
PDB Ligand Accession
VIB
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JZRWCGZRTZMZEH-UHFFFAOYSA-N
SMILES
Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCO
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Mol*
Structure: 3LM8
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Color Legend
Unassigned regionsLigand / hetero atomse3lm8A1e3lm8A2e3lm8B1e3lm8B2e3lm8C1e3lm8C2e3lm8D1e3lm8D2
ECOD domains from experimental PDB structures interacting with ligand DB00152
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O34664DB00152VIB3lm8e3lm8A1A:2-132
O34664DB00152VIB3lm8e3lm8A2A:133-215
O34664DB00152VIB3lm8e3lm8B1B:133-215
O34664DB00152VIB3lm8e3lm8B2B:2-132
O34664DB00152VIB3lm8e3lm8C1C:133-215
O34664DB00152VIB3lm8e3lm8C2C:2-132
O34664DB00152VIB3lm8e3lm8D1D:133-215
O34664DB00152VIB3lm8e3lm8D2D:2-132