PDB ligand accession: RFA
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: QXSHRHKMCRAIGC-QMGQRXOWSA-N
SMILES: CC1=CC2C3CC(CCN3[Ru+2]45(N2CC1)(N6CCCCC6=C7N4CCCC7)N8CCC=CC8=C9N5C=CCC9)CC1C(C(C(C(C1F)F)C1C(C(C(C(C1F)F)NC1C2CC3CC(C2)CC1C3)F)F)F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organohalogen compounds
- Class: Alkyl halides
- Subclass: Cyclohexyl halides
- Class: Alkyl halides
- Superclass: Organohalogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1K2O | Download | Experimental | e1k2oA1 e1k2oB1 e1k2oB1 | Cytochrome P450 Cytochrome P450 Cytochrome P450 | LigPlot |