Attributes
UniProt ID
Protein Name
Bifunctional purine biosynthesis protein ATIC
Ligand Name
5-[(5S)-5-ethyl-5-methyl-6-oxo-1,4,5,6-tetrahydropyridin-3-yl]-N-(6-fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)thiophene-2-sulfonamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SNANFQWFSNYTEC-NRFANRHFSA-N
SMILES
CCC1(CC(=CNC1=O)c2ccc(s2)S(=O)(=O)Nc3cc4c(cc3F)C=CNC4=O)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5UY8
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Color Legend
Unassigned regionsLigand / hetero atomse5uy8A1e5uy8A2e5uy8A3e5uy8B1e5uy8B2e5uy8B3e5uy8C1e5uy8C2e5uy8C3e5uy8D1e5uy8D2e5uy8D3
ECOD domains from experimental PDB structures interacting with ligand 8UM
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P31939 | n/a | 8UM | 5uy8 | e5uy8A1 | A:200-390 |
| P31939 | n/a | 8UM | 5uy8 | e5uy8A3 | A:391-592 |
| P31939 | n/a | 8UM | 5uy8 | e5uy8B1 | B:391-592 |
| P31939 | n/a | 8UM | 5uy8 | e5uy8B3 | B:200-390 |
| P31939 | n/a | 8UM | 5uy8 | e5uy8C2 | C:391-592 |
| P31939 | n/a | 8UM | 5uy8 | e5uy8C3 | C:200-390 |
| P31939 | n/a | 8UM | 5uy8 | e5uy8D2 | D:391-592 |
| P31939 | n/a | 8UM | 5uy8 | e5uy8D3 | D:200-390 |