PDB ligand accession: NEA
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: APAPOJUCRZTCHD-WOUKDFQISA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CSCCN)O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: 5'-deoxyribonucleosides
- Subclass: 5'-deoxy-5'-thionucleosides
- Class: 5'-deoxyribonucleosides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2IBS | Download | Experimental | e2ibsA2 e2ibsD2 | Rossmann-like Rossmann-like | LigPlot |
2NP6 | Download | Experimental | e2np6A2 e2np6D2 | Rossmann-like Rossmann-like | LigPlot |
1G38 | Download | Experimental | e1g38A2 e1g38D2 | Rossmann-like Rossmann-like | LigPlot |
2IH5 | Download | Experimental | e2ih5A2 | Rossmann-like | LigPlot |
2NP7 | Download | Experimental | e2np7A2 | Rossmann-like | LigPlot |
2IH2 | Download | Experimental | e2ih2A2 e2ih2D2 | Rossmann-like Rossmann-like | LigPlot |
2IH4 | Download | Experimental | e2ih4A2 e2ih4D2 | Rossmann-like Rossmann-like | LigPlot |
2IBT | Download | Experimental | e2ibtA2 e2ibtD2 | Rossmann-like Rossmann-like | LigPlot |