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 |
---|---|---|---|---|---|
7ZDP | Download | Experimental | e7zdp11 e7zdp12 e7zdp13 | beta-Grasp Bromodomain-like Nqo1 FMN-binding domain-like | LigPlot |
7ZDJ | Download | Experimental | e7zdj11 e7zdj12 e7zdj13 | Bromodomain-like beta-Grasp Nqo1 FMN-binding domain-like | LigPlot |
7ZEB | Download | Experimental | e7zeb11 e7zeb12 e7zeb13 | Bromodomain-like beta-Grasp Nqo1 FMN-binding domain-like | LigPlot |