Crystal structure of AP2 associated kinase 1 isoform 1 complexed with ligand N-[3-methoxy-4-(1,3-oxazol-5-YL)PHENYL]-3-(propan-2-YL)PIPERIDINE-2-carboxamide

Structure

x-ray diffraction · resolution 2.65 · 2 distinct chains.

Ligands and binding sites

• YFS · N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-D-leucinamide · ligand · chains A
• YFV · 5-[(4-aminopiperidin-1-yl)methyl]-N-{3-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]phenyl}pyrrolo[2,1-F][1,2, 4]triazin-4-amine · ligand · chains B
• SO4 · Sulfate ion · ion · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

• 7LVH · Crystal structure of AP2 associated kinase 1 isoform 1 complexed with ligand… · the same entry in another collection · chain A against A, TM-score 1.00
• Q3UHJ0 · AlphaFold monomer V2.0 prediction for AP2-associated protein kinase 1 (Q3UHJ0) · a predicted model of the same protein · chain B against A, TM-score 0.99

Analyse

• Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
• Every structure of UniProt Q3UHJ0
• Elsewhere: RCSB PDB 7LVH · PDBe 7LVH · UniProt Q3UHJ0