PDB ligand accession: 322
DrugBank: DB06998
PubChem:
ChEMBL: n/a
InChI Key: ABQHPGHMYXJJIV-MRVPVSSYSA-N
SMILES: CCOc1cc(c(c(c1O)Br)Br)CC2C(=O)N(C(=S)S2)CC(=O)O
Drug action: n/a
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 |
---|---|---|---|---|---|
3D1G | Download | Experimental | e3d1gA2 e3d1gA3 e3d1gB2 e3d1gB3 | DNA clamp DNA clamp DNA clamp DNA clamp | LigPlot |