PDB ligand accession: PEP
DrugBank: DB01819
PubChem: 1005;58114173;59658623;
ChEMBL:
InChI Key: DTBNBXWJWCWCIK-UHFFFAOYSA-N
SMILES: C=C(C(=O)O)OP(=O)(O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Organic phosphoric acids and derivatives
- Subclass: Phosphate esters
- Class: Organic phosphoric acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1HFB | Download | Experimental | e1hfbA1 e1hfbB1 e1hfbC1 e1hfbD1 e1hfbE1 e1hfbF1 e1hfbG1 e1hfbH1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
1OAB | Download | Experimental | e1oabA1 e1oabB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
1OF8 | Download | Experimental | e1of8A1 e1of8B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
1OFA | Download | Experimental | e1ofaA1 e1ofaB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |