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 |
---|---|---|---|---|---|
4RGQ | Download | Experimental | e4rgqA1 e4rgqB1 e4rgqB2 e4rgqC1 e4rgqD1 | alpha-helical domain in dehydroquinate synthase-like enzymes alpha-helical domain in dehydroquinate synthase-like enzymes Flavodoxin-like alpha-helical domain in dehydroquinate synthase-like enzymes alpha-helical domain in dehydroquinate synthase-like enzymes | LigPlot |
4RFL | Download | Experimental | e4rflA1 e4rflB1 e4rflC1 e4rflD1 | alpha-helical domain in dehydroquinate synthase-like enzymes alpha-helical domain in dehydroquinate synthase-like enzymes alpha-helical domain in dehydroquinate synthase-like enzymes alpha-helical domain in dehydroquinate synthase-like enzymes | LigPlot |