DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Bifunctional purine biosynthesis protein ATIC
Ligand Name
2-{4-[2-(2-AMINO-4-OXO-4,7-DIHYDRO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ETHYL]-BENZOYLAMINO}-PENTANEDIOIC ACID
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WBXPDJSOTKVWSJ-ZDUSSCGKSA-N
SMILES
c1cc(ccc1CCc2c[nH]c3c2C(=O)N=C(N3)N)C(=O)NC(CCC(=O)O)C(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: P31939_F1
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomsnD1nD2
ECOD domains from AlphaFold model interacting with ligand DB00642
UniProtDrugBankPDB LigandECOD DomainRange Definition
P31939DB00642LYAnD16-195
P31939DB00642LYAnD2201-590