DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Transketolase 1
Ligand Name
2-[3-[(4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL]-2-(1,2-DIHYDROXYETHYL)-4-METHYL-1,3-THIAZOL-3-IUM-5-YL]ETHYL TRIHYDROGEN DIPHOSPHATE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LXZUEFPJZTWGEL-SDNWHVSQSA-N
SMILES
Cc1ncc(c(n1)N)CN2C(=C(SC2=C(CO)O)CCOP(=O)(O)OP(=O)(O)O)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 1GPU
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Color Legend
Unassigned regionsLigand / hetero atomse1gpuA1e1gpuA2e1gpuA3e1gpuB1e1gpuB2e1gpuB3
ECOD domains from experimental PDB structures interacting with ligand THD
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P23254n/aTHD1gpue1gpuA2A:338-534
P23254n/aTHD1gpue1gpuA3A:3-337
P23254n/aTHD1gpue1gpuB2B:338-534
P23254n/aTHD1gpue1gpuB3B:3-337