DrugDomain logoDrugDomain

Attributes

UniProt ID
Q5A5E0
Protein Name
Dihydrofolate reductase
Ligand Name
NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
DrugBank ID
DB02338
PDB Ligand Accession
NDP
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ACFIXJIJDZMPPO-NNYOXOHSSA-N
SMILES
c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=CCC(=C5)C(=O)N)O)O)O)OP(=O)(O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Mol*
Structure: 3QLR
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Color Legend
Unassigned regionsLigand / hetero atomse3qlrA1e3qlrB1
ECOD domains from experimental PDB structures interacting with ligand DB02338
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q5A5E0DB02338NDP3qlre3qlrA1A:1-192
Q5A5E0DB02338NDP3qlre3qlrB1B:1-192
Q5A5E0DB02338NDP3qlse3qlsA1A:1-192
Q5A5E0DB02338NDP3qlse3qlsB1B:1-192
Q5A5E0DB02338NDP3qlwe3qlwA1A:3-192
Q5A5E0DB02338NDP3qlwe3qlwB1B:3-192
Q5A5E0DB02338NDP4h95e4h95A1A:4-192
Q5A5E0DB02338NDP4h95e4h95B1B:4-192
Q5A5E0DB02338NDP4h96e4h96A1A:4-192
Q5A5E0DB02338NDP4h96e4h96B1B:4-192
Q5A5E0DB02338NDP4h97e4h97A1A:3-192
Q5A5E0DB02338NDP4h97e4h97B1B:3-192