PDB ligand accession: 1VU
DrugBank: DB02912
PubChem:
ChEMBL: n/a
InChI Key: QAQREVBBADEHPA-IEXPHMLFSA-N
SMILES: CCC(=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 |
---|---|---|---|---|---|
8H66 | Download | Experimental | e8h66E1 e8h66C1 e8h66D1 e8h66F1 e8h66B1 e8h66A1 e8h66G1 e8h66H1 | Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy | LigPlot |
5H84 | Download | Experimental | e5h84A1 | Nat/Ivy | LigPlot |