PDB ligand accession: APA
DrugBank: DB02018
PubChem:
ChEMBL: n/a
InChI Key: FAFAPKBWTCDDJC-QMMMGPOBSA-N
SMILES: c1cc(ccc1CC(C(=O)O)O)C(=N)N
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 |
---|---|---|---|---|---|
1A0L | Download | Experimental | e1a0lA1 e1a0lB1 e1a0lC1 e1a0lD1 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |