Attributes
UniProt ID
Protein Name
Bifunctional dihydrofolate reductase-thymidylate synthase
Ligand Name
[2-({4-[(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl]benzene-1-carbonyl}amino)phenyl]acetic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NCEMLZMBZDJVMM-UHFFFAOYSA-N
SMILES
c1ccc(c(c1)CC(=O)O)NC(=O)c2ccc(cc2)Cc3c[nH]c4c3C(=O)NC(=N4)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 6PF9
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Color Legend
Unassigned regionsLigand / hetero atomse6pf9A1e6pf9A2e6pf9B1e6pf9B2e6pf9C1e6pf9C2e6pf9D1e6pf9D2e6pf9E1e6pf9E2
ECOD domains from experimental PDB structures interacting with ligand OF7
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A0S4TER9 | n/a | OF7 | 6pf9 | e6pf9A1 | A:180-521 |
| A0A0S4TER9 | n/a | OF7 | 6pf9 | e6pf9B1 | B:180-521 |
| A0A0S4TER9 | n/a | OF7 | 6pf9 | e6pf9C1 | C:180-521 |
| A0A0S4TER9 | n/a | OF7 | 6pf9 | e6pf9D2 | D:180-521 |
| A0A0S4TER9 | n/a | OF7 | 6pf9 | e6pf9E1 | E:179-521 |