PDB ligand accession: 295
DrugBank: DB06946
PubChem:
ChEMBL: n/a
InChI Key: DWYLYIVEFVSGCP-YUMQZZPRSA-N
SMILES: c1cc(ccc1C(C(C(=O)O)O)O)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Phenylpropanoic acids
- Subclass: None
- Class: Phenylpropanoic acids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2RJR | Download | Experimental | e2rjrA1 e2rjrA2 e2rjrB1 | L-aspartase middle domain-like L-aspartase N-terminal domain-like L-aspartase middle domain-like | LigPlot |