PDB ligand accession: NDP
DrugBank: DB02338
PubChem: 5884;134821689;
ChEMBL:
InChI Key: ACFIXJIJDZMPPO-NNYOXOHSSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=CCC(=C5)C(=O)N)O)O)O)OP(=O)(O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: (5'->5')-dinucleotides
- Subclass: None
- Class: (5'->5')-dinucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2YAU | Download | Experimental | e2yauB4 e2yauA1 e2yauA2 e2yauA3 e2yauB4 e2yauB5 e2yauB6 | FAD-linked reductases, C-terminal domain-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like | LigPlot |
4ADW | Download | Experimental | e4adwA1 e4adwA2 e4adwA3 e4adwB1 e4adwB2 e4adwB3 | FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like | LigPlot |
2X50 | Download | Experimental | e2x50A1 e2x50A2 e2x50A3 e2x50B1 e2x50B2 e2x50B3 | FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like | LigPlot |
4APN | Download | Experimental | e4apnA1 e4apnA2 e4apnA3 e4apnB4 e4apnB5 e4apnB6 e4apnA1 e4apnA3 | FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like | LigPlot |
2W0H | Download | Experimental | e2w0hA1 e2w0hA2 e2w0hA3 e2w0hB1 e2w0hB2 e2w0hB3 | FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like Rossmann-like | LigPlot |