PDB ligand accession: MPD
DrugBank: DB03564
PubChem:
ChEMBL: n/a
InChI Key: SVTBMSDMJJWYQN-YFKPBYRVSA-N
SMILES: CC(CC(C)(C)O)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 |
|---|---|---|---|---|---|
| 2EJ6 | Download | Experimental | e2ej6A1 e2ej6A2 e2ej6B2 e2ej6B1 | ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |
| 2EHQ | Download | Experimental | e2ehqA1 e2ehqA2 e2ehqB1 e2ehqB2 | ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |
| 2BJK | Download | Experimental | e2bjkA1 e2bjkB1 | ALDH-like ALDH-like | LigPlot |
| 2EIT | Download | Experimental | e2eitA2 e2eitB1 e2eitB2 e2eitA1 e2eitA2 e2eitB1 e2eitB2 | ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |
| 2J40 | Download | Experimental | e2j40B1 e2j40B2 | ALDH-like ALDH-like | LigPlot |
| 2BJA | Download | Experimental | e2bjaA2 e2bjaB1 e2bjaB2 | ALDH-like ALDH-like ALDH-like | LigPlot |
| 2EHU | Download | Experimental | e2ehuA1 e2ehuA2 e2ehuB1 e2ehuB1 e2ehuB2 | ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |
| 2EJD | Download | Experimental | e2ejdA1 e2ejdA2 e2ejdB1 | ALDH-like ALDH-like ALDH-like | LigPlot |
| 2BHQ | Download | Experimental | e2bhqA2 e2bhqA1 e2bhqB1 e2bhqB2 | ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |
| 2EJL | Download | Experimental | e2ejlA1 e2ejlA2 e2ejlB1 | ALDH-like ALDH-like ALDH-like | LigPlot |
| 2BHP | Download | Experimental | e2bhpA1 e2bhpA2 e2bhpB2 e2bhpA1 e2bhpB1 e2bhpB2 | ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |
| 2J5N | Download | Experimental | e2j5nA2 e2j5nB1 e2j5nB2 | ALDH-like ALDH-like ALDH-like | LigPlot |
| 2IY6 | Download | Experimental | e2iy6A1 e2iy6A2 e2iy6B2 e2iy6A1 e2iy6A2 e2iy6B1 e2iy6B2 | ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |
| 2EII | Download | Experimental | e2eiiA1 e2eiiA2 e2eiiB2 e2eiiB1 e2eiiB2 | ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |