PDB ligand accession: BME
DrugBank: DB03345
PubChem:
ChEMBL:
InChI Key: DGVVWUTYPXICAM-UHFFFAOYSA-N
SMILES: C(CS)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organosulfur compounds
- Class: Thiols
- Subclass: Alkylthiols
- Class: Thiols
- Superclass: Organosulfur compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5ESO | Download | Experimental | e5esoC3 e5esoD2 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
5ESU | Download | Experimental | e5esuC1 e5esuD1 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |