PDB ligand accession: TH2
DrugBank: DB08619
PubChem:
ChEMBL: n/a
InChI Key: CJQNBXFUHQZFOE-VYAQIDIUSA-N
SMILES: CC12CCC3C(C1CCC2OC(=O)CCC(=O)O)CCC4=CC(=O)CCC34C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Steroid esters
- 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 |
---|---|---|---|---|---|
2CBT | Download | Experimental | e2cbtA1 e2cbtB1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
2CBQ | Download | Experimental | e2cbqA1 e2cbqF1 e2cbqB1 e2cbqC1 e2cbqA1 e2cbqC1 e2cbqD1 e2cbqE1 e2cbqB1 e2cbqF1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
2CBO | Download | Experimental | e2cboA1 | Immunoglobulin-like beta-sandwich | LigPlot |