PDB ligand accession: DGT
DrugBank: DB02181
PubChem: 65103;5280333;135398599;
ChEMBL:
InChI Key: HAAZLUGHYHWQIW-KVQBGUIXSA-N
SMILES: c1nc2c(n1C3CC(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)N=C(NC2=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Purine nucleotides
- Subclass: Purine deoxyribonucleotides
- Class: Purine nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 4TO4 | Download | Experimental | e4to4A1 e4to4B1 e4to4C1 e4to4A1 e4to4B1 e4to4D1 e4to4A1 e4to4C1 e4to4D1 e4to4B1 e4to4C1 e4to4D1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4TO6 | Download | Experimental | e4to6A1 e4to6C1 e4to6D1 e4to6B1 e4to6C1 e4to6D1 e4to6A1 e4to6B1 e4to6C1 e4to6A1 e4to6B1 e4to6D1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4TO2 | Download | Experimental | e4to2A1 e4to2B1 e4to2C1 e4to2A1 e4to2B1 e4to2D1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4QFX | Download | Experimental | e4qfxA1 e4qfxB1 e4qfxD1 e4qfxB1 e4qfxC1 e4qfxD1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 7LTT | Download | Experimental | e7lttA1 e7lttB1 e7lttD1 e7lttB1 e7lttC1 e7lttD1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4QFY | Download | Experimental | e4qfyA1 e4qfyB1 e4qfyD1 e4qfyA1 e4qfyB1 e4qfyC1 e4qfyB1 e4qfyC1 e4qfyD1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4TO3 | Download | Experimental | e4to3A1 e4to3B1 e4to3C1 e4to3A1 e4to3B1 e4to3D1 e4to3A1 e4to3C1 e4to3D1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4QG0 | Download | Experimental | e4qg0A1 e4qg0C1 e4qg0D1 e4qg0B1 e4qg0C1 e4qg0D1 e4qg0A1 e4qg0B1 e4qg0C1 e4qg0A1 e4qg0B1 e4qg0D1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 5AO2 | Download | Experimental | e5ao2A1 e5ao2B1 e5ao2C1 e5ao2D1 | PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4TNX | Download | Experimental | e4tnxA1 e4tnxC1 e4tnxD1 e4tnxA1 e4tnxB1 e4tnxD1 e4tnxA1 e4tnxB1 e4tnxC1 e4tnxB1 e4tnxC1 e4tnxD1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4TNY | Download | Experimental | e4tnyA1 e4tnyA1 e4tnyC1 e4tnyB1 e4tnyC1 e4tnyB1 e4tnyD1 e4tnyA1 e4tnyB1 e4tnyD1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 7LU5 | Download | Experimental | e7lu5A1 e7lu5C1 e7lu5D1 e7lu5A1 e7lu5B1 e7lu5D1 e7lu5B1 e7lu5C1 e7lu5D1 e7lu5E1 e7lu5G1 e7lu5H1 e7lu5E1 e7lu5F1 e7lu5G1 e7lu5F1 e7lu5G1 e7lu5H1 e7lu5I1 e7lu5J1 e7lu5K1 e7lu5I1 e7lu5J1 e7lu5L1 e7lu5I1 e7lu5K1 e7lu5L1 e7lu5M1 e7lu5N1 e7lu5O1 e7lu5M1 e7lu5N1 e7lu5P1 e7lu5M1 e7lu5O1 e7lu5P1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4ZWE | Download | Experimental | e4zweA1 e4zweB1 e4zweC1 e4zweA1 e4zweB1 e4zweD1 e4zweC1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4BZB | Download | Experimental | e4bzbA1 e4bzbC1 e4bzbD1 e4bzbB1 e4bzbC1 e4bzbD1 e4bzbA1 e4bzbB1 e4bzbC1 e4bzbA1 e4bzbB1 e4bzbD1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4QFZ | Download | Experimental | e4qfzA1 e4qfzC1 e4qfzD1 e4qfzA1 e4qfzB1 e4qfzC1 e4qfzA1 e4qfzB1 e4qfzD1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |
| 4MZ7 | Download | Experimental | e4mz7A1 e4mz7B1 e4mz7B1 | PDEase-like PDEase-like PDEase-like | LigPlot |