PDB ligand accession: BCO
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: CRFNGMNYKDXRTN-CITAKDKDSA-N
SMILES: CCCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Fatty Acyls
- Subclass: Fatty acyl thioesters
- Class: Fatty Acyls
- Superclass: Lipids and lipid-like molecules
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8H65 | Download | Experimental | e8h65C1 e8h65D1 e8h65E1 e8h65F1 e8h65B1 e8h65A1 e8h65G1 e8h65H1 | Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy | LigPlot |
5H86 | Download | Experimental | e5h86A1 | Nat/Ivy | LigPlot |