Attributes
UniProt ID
Protein Name
Aldehyde dehydrogenase, dimeric NADP-preferring
Ligand Name
N-(4-{[4-(methylsulfonyl)-2-nitrophenyl]amino}phenyl)acetamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JXZXJHWSQKISBZ-UHFFFAOYSA-N
SMILES
CC(=O)Nc1ccc(cc1)Nc2ccc(cc2[N+](=O)[O-])S(=O)(=O)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 4H80
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Color Legend
Unassigned regionsLigand / hetero atomse4h80A1e4h80A2e4h80B1e4h80B2e4h80C1e4h80C2e4h80D1e4h80D2e4h80E1e4h80E2e4h80F1e4h80F2e4h80G1e4h80G2e4h80H1e4h80H2
ECOD domains from experimental PDB structures interacting with ligand 04T
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P30838 | n/a | 04T | 4h80 | e4h80A1 | A:1-211 |
| P30838 | n/a | 04T | 4h80 | e4h80A2 | A:212-446 |
| P30838 | n/a | 04T | 4h80 | e4h80B1 | B:1-211 |
| P30838 | n/a | 04T | 4h80 | e4h80B2 | B:212-446 |
| P30838 | n/a | 04T | 4h80 | e4h80C1 | C:1-211 |
| P30838 | n/a | 04T | 4h80 | e4h80C2 | C:212-447 |
| P30838 | n/a | 04T | 4h80 | e4h80D1 | D:212-446 |
| P30838 | n/a | 04T | 4h80 | e4h80D2 | D:1-211 |
| P30838 | n/a | 04T | 4h80 | e4h80E1 | E:212-446 |
| P30838 | n/a | 04T | 4h80 | e4h80E2 | E:1-211 |
| P30838 | n/a | 04T | 4h80 | e4h80F1 | F:1-211 |
| P30838 | n/a | 04T | 4h80 | e4h80F2 | F:212-446 |
| P30838 | n/a | 04T | 4h80 | e4h80G1 | G:212-446 |
| P30838 | n/a | 04T | 4h80 | e4h80G2 | G:1-211 |
| P30838 | n/a | 04T | 4h80 | e4h80H1 | H:1-211 |
| P30838 | n/a | 04T | 4h80 | e4h80H2 | H:212-447 |