DrugDomain logoDrugDomain

Attributes

UniProt ID
Q8T5T8
Protein Name
Bifunctional dihydrofolate reductase-thymidylate synthase
Ligand Name
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
DrugBank ID
DB03461
PDB Ligand Accession
NAP
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XJLXINKUBYWONI-NNYOXOHSSA-N
SMILES
c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)OP(=O)(O)O)O)O)O)C(=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: 3HBB
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Color Legend
Unassigned regionsLigand / hetero atomse3hbbA1e3hbbA2e3hbbB1e3hbbB2e3hbbC1e3hbbC2e3hbbD1e3hbbD2
ECOD domains from experimental PDB structures interacting with ligand DB03461
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q8T5T8DB03461NAP3hbbe3hbbA2A:23-226
Q8T5T8DB03461NAP3hbbe3hbbB2B:2-209
Q8T5T8DB03461NAP3hbbe3hbbC2C:1-209
Q8T5T8DB03461NAP3hbbe3hbbD2D:1-209
Q8T5T8DB03461NAP3kjse3kjsA2A:2-209
Q8T5T8DB03461NAP3kjse3kjsB2B:3-209
Q8T5T8DB03461NAP3kjse3kjsC3C:2-209
Q8T5T8DB03461NAP3kjse3kjsD2D:2-209