PDB ligand accession: WSA
DrugBank: n/a
PubChem: 24771756;44593542;
ChEMBL:
InChI Key: RQAVKMXDGHWLGD-BFNSABJLSA-N
SMILES: c1ccc2c(c1)c(c[nH]2)CC(C(=O)NS(=O)(=O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Purine nucleosides
- Subclass: None
- Class: Purine nucleosides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4EQH | Download | Experimental | e4eqhA2 e4eqhB2 | HIT-like HIT-like | LigPlot |