PDB ligand accession: PPE
DrugBank: DB01813
PubChem:
ChEMBL: n/a
InChI Key: JMRKOGDJNHPMHS-JTQLQIEISA-O
SMILES: Cc1c(c(c(c[nH+]1)COP(=O)(O)O)CNC(CCC(=O)O)C(=O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1WKH | Download | Experimental | e1wkhB3 e1wkhA2 e1wkhA3 e1wkhB2 e1wkhB3 e1wkhA3 | PLP-dependent transferases C-terminal domain in some PLP-dependent transferases PLP-dependent transferases C-terminal domain in some PLP-dependent transferases PLP-dependent transferases PLP-dependent transferases | LigPlot |