PDB ligand accession: AT5
DrugBank: DB04631
PubChem: 197273;54676868;
ChEMBL:
InChI Key: OVULNOOPECCZRG-CIUDSAMLSA-N
SMILES: CC(CC(C)C(=O)C1=C(C(=C(NC1=O)OC)OC)O)C(CCl)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3AEE | Download | Experimental | e3aeeB1 e3aeeC1 e3aeeD1 | alpha-helical ferredoxin-like Transmembrane heme-binding four-helical bundle Transmembrane heme-binding four-helical bundle | LigPlot |