PDB ligand accession: NAP
DrugBank: DB03461
PubChem: 5885;57525501;
ChEMBL:
InChI Key: XJLXINKUBYWONI-NNYOXOHSSA-N
SMILES: c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)OP(=O)(O)O)O)O)O)C(=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 |
---|---|---|---|---|---|
2WEK | Download | Experimental | e2wekA1 e2wekA2 e2wekB1 e2wekB2 | GroES-like Rossmann-like GroES-like Rossmann-like | LigPlot |
2X1H | Download | Experimental | e2x1hA1 e2x1hA2 e2x1hB1 e2x1hB2 | GroES-like Rossmann-like GroES-like Rossmann-like | LigPlot |
2C0C | Download | Experimental | e2c0cA1 e2c0cA2 e2c0cB2 e2c0cA1 e2c0cA2 e2c0cB1 e2c0cB2 | GroES-like Rossmann-like Rossmann-like GroES-like Rossmann-like GroES-like Rossmann-like | LigPlot |
7ZEJ | Download | Experimental | e7zejA1 e7zejA2 e7zejB1 e7zejB2 | GroES-like Rossmann-like Rossmann-like GroES-like | LigPlot |
2X7H | Download | Experimental | e2x7hA1 e2x7hA2 e2x7hB1 e2x7hB2 | Rossmann-like GroES-like GroES-like Rossmann-like | LigPlot |