DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Dihydrofolate reductase type 1
Ligand Name
4'-chloro-3'-[(2S)-4-(2,4-diamino-6-ethylpyrimidin-5-yl)but-3-yn-2-yl][1,1'-biphenyl]-4-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LTCWEPCGQPOIRQ-ZDUSSCGKSA-N
SMILES
CCc1c(c(nc(n1)N)N)C#CC(C)c2cc(ccc2Cl)c3ccc(cc3)C(=O)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 7REG
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Color Legend
Unassigned regionsLigand / hetero atomse7regA1e7regB1
ECOD domains from experimental PDB structures interacting with ligand 4SI
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P00382n/a4SI7rege7regA1A:1-157
P00382n/a4SI7rege7regB1B:1-157