PDB ligand accession: RO4
DrugBank: DB08482
PubChem:
ChEMBL:
InChI Key: XKRONJXEXGFBRZ-ZNMIVQPWSA-N
SMILES: CCOC(=O)C(C)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)CC(=O)NO
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2TCL | Download | Experimental | e2tclA1 | Zincin-like | LigPlot |