PDB ligand accession: 2BL
DrugBank: DB06951
InChI Key: KPHLTCNXHCHMOW-MNOVXSKESA-N
SMILES: CCC(C(C(=O)O)NS(=O)(=O)c1ccc(cc1)C)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Toluenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
Q9UNI1 | Download | Predicted | Q9UNI1_F1_nD1 | cradle loop barrel |