PDB ligand accession: 017
DrugBank: DB01264
PubChem:
ChEMBL:
InChI Key: CJBJHOAVZSMMDJ-HEXNFIEUSA-N
SMILES: CC(C)CN(CC(C(Cc1ccccc1)NC(=O)OC2COC3C2CCO3)O)S(=O)(=O)c4ccc(cc4)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzenesulfonamides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3LZV | Download | Experimental | e3lzvA1 e3lzvB1 | cradle loop barrel cradle loop barrel | LigPlot |
1T3R | Download | Experimental | e1t3rB1 e1t3rA1 | cradle loop barrel cradle loop barrel | LigPlot |
3OY4 | Download | Experimental | e3oy4A1 e3oy4B1 | cradle loop barrel cradle loop barrel | LigPlot |
3EKT | Download | Experimental | e3ektA1 e3ektB1 e3ektC1 e3ektD1 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |
3EM6 | Download | Experimental | e3em6A1 e3em6B1 | cradle loop barrel cradle loop barrel | LigPlot |
3OXW | Download | Experimental | e3oxwB1 e3oxwA1 e3oxwD1 e3oxwC1 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |