PDB ligand accession: PG4
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: UWHCKJMYHZGTIT-UHFFFAOYSA-N
SMILES: C(COCCOCCOCCO)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4RJI | Download | Experimental | e4rjiB1 e4rjiB2 e4rjiC1 e4rjiC2 | Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
4RJJ | Download | Experimental | e4rjjA2 e4rjjA3 e4rjjB1 e4rjjB3 e4rjjC2 e4rjjD1 e4rjjD3 e4rjjD2 e4rjjD3 e4rjjA1 e4rjjE1 e4rjjE3 e4rjjF2 e4rjjF3 e4rjjG1 e4rjjG3 e4rjjH1 e4rjjH2 e4rjjH3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |
4RJK | Download | Experimental | e4rjkA2 e4rjkB2 e4rjkB1 e4rjkC2 e4rjkD1 e4rjkD2 e4rjkD1 e4rjkD3 e4rjkE1 e4rjkE2 e4rjkE3 e4rjkF1 e4rjkG1 e4rjkG3 e4rjkH1 e4rjkH2 e4rjkH3 | Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Rossmann-like Thiamin diphosphate-binding fold (THDP-binding) Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |