PDB ligand accession: GM6
DrugBank: DB02255
PubChem:
ChEMBL:
InChI Key: NITYDPDXAAFEIT-DYVFJYSZSA-N
SMILES: CC(C)CC(CC(=O)NO)C(=O)NC(Cc1c[nH]c2c1cccc2)C(=O)NC
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 |
---|---|---|---|---|---|
4PKW | Download | Experimental | e4pkwA1 e4pkwA2 | Zincin-like ADP-ribosylation | LigPlot |
1PWU | Download | Experimental | e1pwuA3 e1pwuA1 e1pwuB3 e1pwuB1 | Zincin-like ADP-ribosylation Zincin-like ADP-ribosylation | LigPlot |