PDB ligand accession: EDO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LYCAIKOWRPUZTN-UHFFFAOYSA-N
SMILES: C(CO)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Alcohols and polyols
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 3WF2 | Download | Experimental | e3wf2A1 e3wf2A2 e3wf2B1 e3wf2B2 e3wf2C1 e3wf2D1 e3wf2D2 | TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel TIM beta/alpha-barrel jelly-roll | LigPlot |
| 3WF3 | Download | Experimental | e3wf3A1 e3wf3A2 e3wf3B1 e3wf3B2 e3wf3C1 e3wf3C2 e3wf3D1 e3wf3D2 | TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll | LigPlot |
| 3WF1 | Download | Experimental | e3wf1A1 e3wf1A2 e3wf1B1 e3wf1B2 e3wf1C1 e3wf1D1 | TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 3WEZ | Download | Experimental | e3wezA1 e3wezA2 e3wezB1 e3wezB2 e3wezC1 e3wezC2 e3wezD1 e3wezD2 | TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll | LigPlot |
| 3WF0 | Download | Experimental | e3wf0A1 e3wf0A2 e3wf0B1 e3wf0B2 e3wf0C1 e3wf0C2 e3wf0D1 e3wf0D2 | TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll | LigPlot |
| 3THD | Download | Experimental | e3thdA2 e3thdA3 e3thdB2 e3thdB3 e3thdC7 e3thdC8 e3thdD1 e3thdD2 | jelly-roll TIM beta/alpha-barrel TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll | LigPlot |
| 3THC | Download | Experimental | e3thcA1 e3thcA2 e3thcB2 e3thcB3 e3thcC2 e3thcC3 e3thcD1 e3thcD2 | TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll jelly-roll TIM beta/alpha-barrel | LigPlot |
| 3WF4 | Download | Experimental | e3wf4A1 e3wf4A2 e3wf4B1 e3wf4B2 e3wf4C1 e3wf4C2 e3wf4D1 e3wf4D2 | TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll | LigPlot |