PDB ligand accession: BAK
DrugBank: DB03213
PubChem: 2280;131704234;
ChEMBL: n/a
InChI Key: VVVXDHROXQUONB-UHFFFAOYSA-P
SMILES: c1cc2c(cc1C(=[NH2+])N)[nH]c(n2)C(=O)c3[nH]c4cc(ccc4n3)C(=[NH2+])N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzimidazoles
- Subclass: None
- Class: Benzimidazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1C2J | Download | Experimental | e1c2jA1 | cradle loop barrel | LigPlot |
1C2I | Download | Experimental | e1c2iA1 | cradle loop barrel | LigPlot |
1C2E | Download | Experimental | e1c2eA1 | cradle loop barrel | LigPlot |
1C2D | Download | Experimental | e1c2dA1 | cradle loop barrel | LigPlot |
1C2H | Download | Experimental | e1c2hA1 | cradle loop barrel | LigPlot |