Attributes
UniProt ID
Protein Name
Retinal dehydrogenase 2
Ligand Name
1-(4-cyanophenyl)-N-(3-fluorophenyl)-3-[4-(methylsulfonyl)phenyl]-1H-pyrazole-4-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ZUWUBCCXJATTTE-UHFFFAOYSA-N
SMILES
CS(=O)(=O)c1ccc(cc1)c2c(cn(n2)c3ccc(cc3)C#N)C(=O)Nc4cccc(c4)F
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 6B5H
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Color Legend
Unassigned regionsLigand / hetero atomse6b5hA1e6b5hA2e6b5hB1e6b5hB2e6b5hC1e6b5hC2e6b5hD1e6b5hD2
ECOD domains from experimental PDB structures interacting with ligand CU4
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| O94788 | n/a | CU4 | 6b5h | e6b5hA1 | A:289-518 |
| O94788 | n/a | CU4 | 6b5h | e6b5hA2 | A:27-288 |
| O94788 | n/a | CU4 | 6b5h | e6b5hB1 | B:27-288 |
| O94788 | n/a | CU4 | 6b5h | e6b5hB2 | B:289-518 |
| O94788 | n/a | CU4 | 6b5h | e6b5hC1 | C:27-288 |
| O94788 | n/a | CU4 | 6b5h | e6b5hC2 | C:289-518 |
| O94788 | n/a | CU4 | 6b5h | e6b5hD1 | D:27-288 |
| O94788 | n/a | CU4 | 6b5h | e6b5hD2 | D:289-518 |
| O94788 | n/a | CU4 | 6b5i | e6b5iA1 | A:27-288 |
| O94788 | n/a | CU4 | 6b5i | e6b5iA2 | A:289-518 |
| O94788 | n/a | CU4 | 6b5i | e6b5iB1 | B:27-288 |
| O94788 | n/a | CU4 | 6b5i | e6b5iB2 | B:289-518 |
| O94788 | n/a | CU4 | 6b5i | e6b5iC1 | C:27-288 |
| O94788 | n/a | CU4 | 6b5i | e6b5iC2 | C:289-518 |
| O94788 | n/a | CU4 | 6b5i | e6b5iD1 | D:289-518 |
| O94788 | n/a | CU4 | 6b5i | e6b5iD2 | D:27-288 |