PDB ligand accession: ITL
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: PXQUJGKQZDJTFX-OJQSLKCRSA-N
SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)NC(=O)CCC(C(=O)O)N(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O)C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Bile acids, alcohols and derivatives
- Class: Steroids and steroid derivatives
- Superclass: Lipids and lipid-like molecules
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2K62 | Download | Experimental | e2k62A1 | Lipocalins/Streptavidin | LigPlot |