PDB ligand accession: NAI
DrugBank: DB00157
PubChem:
ChEMBL:
InChI Key: BOPGDPNILDQYTO-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)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 |
---|---|---|---|---|---|
7P63 | Download | Experimental | e7p63F1 e7p63F2 e7p63F3 | Bromodomain-like Nqo1 FMN-binding domain-like beta-Grasp | LigPlot |
7P61 | Download | Experimental | e7p61F1 e7p61F2 e7p61F3 | beta-Grasp Bromodomain-like Nqo1 FMN-binding domain-like | LigPlot |
7P69 | Download | Experimental | e7p69F1 e7p69F2 e7p69F3 | Nqo1 FMN-binding domain-like beta-Grasp Bromodomain-like | LigPlot |
7P64 | Download | Experimental | e7p64F1 e7p64F2 e7p64F3 | Bromodomain-like Nqo1 FMN-binding domain-like beta-Grasp | LigPlot |