PDB ligand accession: 4UW
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: DTAKVQMQJSRZPC-NLGGRGNSSA-N
SMILES: COC1=CC(=CCC1=O)C=CC(=O)OP(=O)(O)OCC2C(C(C(O2)n3cnc4c3ncnc4N)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Purine nucleotides
- Subclass: Purine ribonucleotides
- Class: Purine nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5BSV | Download | Experimental | e5bsvA1 e5bsvA2 e5bsvA4 | Rossmann-like domain in Acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like beta-barrel domain in acetyl-CoA synthetase-like proteins | LigPlot |
5BSW | Download | Experimental | e5bswA1 e5bswA2 e5bswA3 e5bswB1 e5bswB2 e5bswB4 | beta-barrel domain in acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like Rossmann-like domain in Acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like Rossmann-like domain in Acetyl-CoA synthetase-like proteins beta-barrel domain in acetyl-CoA synthetase-like proteins | LigPlot |