Attributes
UniProt ID
Protein Name
Ketohexokinase
Ligand Name
compound
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
DQCBLCPTXXGKPW-GDLZYMKVSA-N
SMILES
CS(=O)(=O)c1cccc2c1c3c([nH]2)-c4cc(ccc4CCC3)CN5CCC(C5)(c6ccccc6)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 8OMD
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Color Legend
Unassigned regionsLigand / hetero atomse8omdA1e8omdB1e8omdC1e8omdD1
ECOD domains from experimental PDB structures interacting with ligand VTJ
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A0J9YU79 | n/a | VTJ | 8omd | e8omdA1 | A:3-298 |
| A0A0J9YU79 | n/a | VTJ | 8omd | e8omdB1 | B:3-298 |
| A0A0J9YU79 | n/a | VTJ | 8omd | e8omdC1 | C:3-298 |
| A0A0J9YU79 | n/a | VTJ | 8omd | e8omdD1 | D:4-298 |