PDB ligand accession: DEY
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: BPHLZVCJUQBQLM-CYBMUJFWSA-N
SMILES: CC(C)CCN1C(=O)C(=C(C(=N1)c2cccs2)O)C3=Nc4ccc(cc4S(=O)(=O)N3)OC(C)C(=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Thiadiazines
- Subclass: Benzothiadiazines
- Class: Thiadiazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3BR9 | Download | Experimental | e3br9A1 e3br9A2 e3br9B1 e3br9B2 | helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits | LigPlot |