PDB ligand accession: GVA
DrugBank: n/a
PubChem: 160464;25201071;
ChEMBL:
InChI Key: UKUBCVAQGIZRHL-UHFFFAOYSA-N
SMILES: [H]N=C(N)NCCCCC(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Fatty Acyls
- Subclass: Fatty acids and conjugates
- Class: Fatty Acyls
- Superclass: Lipids and lipid-like molecules
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2IHV | Download | Experimental | e2ihvB2 e2ihvA3 e2ihvA1 e2ihvA2 e2ihvB3 e2ihvA3 e2ihvB1 e2ihvD2 e2ihvC1 e2ihvC3 e2ihvD3 e2ihvC2 e2ihvD1 | 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 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 | LigPlot |