PDB ligand accession: FE9
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: AEHOAZNVUAGELD-VPXBKTNXSA-K
SMILES: CC1=C2CC(=O)[Fe+2](N2C(=O)C(=C1OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4N=C(NC5=O)N)O)O)C)(C#[O+])(C#[O+])(O)S
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Purine nucleotides
- Subclass: Purine ribonucleotides
- Class: Purine nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4YT4 | Download | Experimental | e4yt4A1 e4yt4A2 | 6-phosphogluconate dehydrogenase C-terminal domain-like Rossmann-like | LigPlot |
6HUX | Download | Experimental | e6huxA1 e6huxA2 | Rossmann-like 6-phosphogluconate dehydrogenase C-terminal domain-like | LigPlot |