Unravelling structure-function interactions between fluorinated heparan sulfate mimetics and signaling proteins

揭示氟化硫酸乙酰肝素类似物与信号蛋白之间的结构-功能相互作用

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Abstract

Fluorinated carbohydrates are emerging scaffolds in glycobiology, enabling the elucidation of the roles of the individual hydroxyl groups of a carbohydrate in protein binding and drug discovery. Herein, we report a divergent strategy to synthesize seven heparan sulfate (HS) mimetics featuring a fluorine atom at the C3 position of the glucuronic acid residue, with the objective of modulating structure-function relationships. The sensitivity of fluorine signals to sulfation patterns was confirmed via (19)F-NMR spectroscopy, while (3) J (HH) coupling and NOE data demonstrated that the glucuronic acid residue retained its (4)C(1) conformation. Glycan microarray analysis and SPR binding studies revealed that a single hydroxyl-to-fluorine substitution in HS mimetics retains the binding of N-acetylated HS sequences for several growth factors and chemokines. Remarkably, GlcNAc6S-GlcA(3F) and GlcNS6S3S-GlcA(3F) exhibited binding properties comparable to those of highly N-sulfated native HS ligands. These findings provide valuable insights for the development of novel therapeutic agents targeting morphogens and cell signalling pathways.

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