PDB ligand accession: 1HR
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZBRKMOHDGFGXLN-BQBZGAKWSA-N
SMILES: c1cc(c(cc1C(=O)C2CC2C(=O)O)Cl)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 |
---|---|---|---|---|---|
4J36 | Download | Experimental | e4j36B1 e4j36B2 | Rossmann-like FAD-linked reductases, C-terminal domain-like | LigPlot |