PDB ligand accession: G8G
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: ODQNREFTECDKDB-FLIBITNWSA-N
SMILES: Cc1ncc(c(n1)N)CN(C=O)C(=C(CCOP(=O)(O)OP(=O)(O)O)S)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organic oxoanionic compounds
- Subclass: Organic pyrophosphates
- Class: Organic oxoanionic compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6DEL | Download | Experimental | e6delA1 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |