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 |
---|---|---|---|---|---|
5EJI | Download | Experimental | e5ejiA1 e5ejiA2 | NAD kinase beta sandwich domain-like Flavodoxin-like | LigPlot |
2I2A | Download | Experimental | e2i2aA1 e2i2aA2 | NAD kinase beta sandwich domain-like Flavodoxin-like | LigPlot |
5EJH | Download | Experimental | e5ejhA1 e5ejhA2 | NAD kinase beta sandwich domain-like Flavodoxin-like | LigPlot |