PDB ligand accession: CR9
DrugBank: DB03555
InChI Key: CMCDWLMEDRBWIR-GTNSWQLSSA-N
SMILES: CC1CCCCC1Oc2cccc(c2[O-])c3[nH]c4cc(c(cc4n3)C(=[NH2+])N)F
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 |
|---|---|---|---|---|
| P07477 | Download | Predicted | P07477_F1_nD1 | cradle loop barrel |
| 1FXY | Predicted | e1fxyA1 | ||
| 1TRN | Predicted | e1trnA1 e1trnB1 | ||
| 2RA3 | Predicted | e2ra3A1 e2ra3B1 | ||
| 4WWY | Predicted | e4wwyA1 e4wwyB1 | ||
| 4WXV | Predicted | e4wxvA1 e4wxvB1 |