Attributes
UniProt ID
Protein Name
Aldehyde dehydrogenase, mitochondrial
Ligand Name
2,3,5-trimethyl-6-propyl-7H-furo[3,2-g][1]benzopyran-7-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ADGUVFJYVNRVPX-UHFFFAOYSA-N
SMILES
CCCC1=C(c2cc3c(c(oc3cc2OC1=O)C)C)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5L13
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Color Legend
Unassigned regionsLigand / hetero atomse5l13A1e5l13A2e5l13B1e5l13B2e5l13C1e5l13C2e5l13D1e5l13D2e5l13E1e5l13E2e5l13F1e5l13F2e5l13G1e5l13G2e5l13H1e5l13H2
ECOD domains from experimental PDB structures interacting with ligand 6ZE
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P05091 | n/a | 6ZE | 5l13 | e5l13A1 | A:7-270 |
| P05091 | n/a | 6ZE | 5l13 | e5l13A2 | A:271-500 |
| P05091 | n/a | 6ZE | 5l13 | e5l13B1 | B:271-500 |
| P05091 | n/a | 6ZE | 5l13 | e5l13B2 | B:7-270 |
| P05091 | n/a | 6ZE | 5l13 | e5l13C1 | C:7-270 |
| P05091 | n/a | 6ZE | 5l13 | e5l13C2 | C:271-500 |
| P05091 | n/a | 6ZE | 5l13 | e5l13D1 | D:7-270 |
| P05091 | n/a | 6ZE | 5l13 | e5l13D2 | D:271-500 |
| P05091 | n/a | 6ZE | 5l13 | e5l13E1 | E:271-500 |
| P05091 | n/a | 6ZE | 5l13 | e5l13E2 | E:6-270 |
| P05091 | n/a | 6ZE | 5l13 | e5l13F1 | F:7-270 |
| P05091 | n/a | 6ZE | 5l13 | e5l13F2 | F:271-500 |
| P05091 | n/a | 6ZE | 5l13 | e5l13G1 | G:7-270 |
| P05091 | n/a | 6ZE | 5l13 | e5l13G2 | G:271-500 |
| P05091 | n/a | 6ZE | 5l13 | e5l13H1 | H:7-270 |
| P05091 | n/a | 6ZE | 5l13 | e5l13H2 | H:271-500 |