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 |
|---|---|---|---|---|---|
| 4HSO | Download | Experimental | e4hsoA1 e4hsoB1 e4hsoC1 e4hsoD1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 4UCG | Download | Experimental | e4ucgA1 e4ucgB1 e4ucgC1 e4ucgD1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 5DCB | Download | Experimental | e5dcbA1 e5dcbB1 e5dcbC1 e5dcbD1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 5D03 | Download | Experimental | e5d03A1 e5d03B1 e5d03C1 e5d03D1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 4HSN | Download | Experimental | e4hsnA1 e4hsnB1 e4hsnC1 e4hsnD1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 5D09 | Download | Experimental | e5d09A1 | TIM beta/alpha-barrel | LigPlot |
| 5CZ0 | Download | Experimental | e5cz0A1 e5cz0B1 e5cz0C1 e5cz0D1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 5CZS | Download | Experimental | e5czsA1 e5czsB1 e5czsC1 e5czsD1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 5D02 | Download | Experimental | e5d02A1 e5d02B1 e5d02C1 e5d02D1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 5D05 | Download | Experimental | e5d05A1 e5d05B1 e5d05C1 e5d05D1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |