PDB ligand accession: SAE
DrugBank: DB03070
PubChem:
ChEMBL:
InChI Key: SKNBJMQZTZPCPF-QZTLEVGFSA-N
SMILES: c1c(nc([se]1)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)O)O)C(=O)N
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Purine nucleotides
- Subclass: Purine nucleotide sugars
- Class: Purine nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1B3O | Download | Experimental | e1b3oA1 e1b3oB2 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |