PDB ligand accession: 5PU
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: VUDGMYIWOPKVSL-SNVBAGLBSA-N
SMILES: c1cc(ccc1CC(CCC(=O)NO)C(=O)O)C(=O)O
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 |
---|---|---|---|---|---|
5ELY | Download | Experimental | e5elyA1 e5elyA2 | The "swivelling" beta/beta/alpha domains Phosphorylase/hydrolase-like | LigPlot |