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 |
|---|---|---|---|---|---|
| 3KF0 | Download | Experimental | e3kf0B1 | cradle loop barrel | LigPlot |
| 3KFN | Download | Experimental | e3kfnB1 | cradle loop barrel | LigPlot |
| 3KFR | Download | Experimental | e3kfrA1 e3kfrB1 | cradle loop barrel cradle loop barrel | LigPlot |
| 3KFS | Download | Experimental | e3kfsA1 e3kfsB1 e3kfsB1 | cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |
| 4E43 | Download | Experimental | e4e43B1 | cradle loop barrel | LigPlot |
| 3KFP | Download | Experimental | e3kfpA1 | cradle loop barrel | LigPlot |