PDB ligand accession: 847
DrugBank: DB02063
PubChem: 131704187;135559083;
ChEMBL: n/a
InChI Key: SJMNJNRKVVVGRB-SECBINFHSA-L
SMILES: c1cc2c(cc1C(=[NH2+])N)nc([nH]2)c3cc(cc(c3[O-])Br)C(CC(=O)[O-])C(=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzimidazoles
- Subclass: Phenylbenzimidazoles
- Class: Benzimidazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1O2U | Download | Experimental | e1o2uA1 | cradle loop barrel | LigPlot |
1O2Y | Download | Experimental | e1o2yA1 | cradle loop barrel | LigPlot |
1O2X | Download | Experimental | e1o2xA1 | cradle loop barrel | LigPlot |
1O2W | Download | Experimental | e1o2wA1 | cradle loop barrel | LigPlot |
1O2V | Download | Experimental | e1o2vA1 | cradle loop barrel | LigPlot |