蛋白相互作用大环化合物库

In the structural mimetics category, we have designed small molecule and macrocyclic scaffolds that mimic the backbone geometry and the projection of side chains as observed in peptide structures at PPI interfaces. The designs cover b-turn / loop mimetics and a-helix mimetics. Since helices present at the interface in 62% of all protein-protein interactions, we have focused on designs including mimics with the substitution geometry of an a-helices, as well as designs that mimic the location of “hot-spot” side chains in helix-mediated PPIs. Epitope mimetics have been designed using structure-based designs focusing on the locations of hot-spot residues at the PPI interfaces.

在结构模拟物类别中，我们设计了小分子和大环骨架来模拟PPI界面肽结构中的骨架几何结构和侧链的投影。设计涵盖了b-转角/环类似物和α-螺旋类似物。由于62%的蛋白质相互作用中存在螺旋，我们专注于设计、包括模拟α-螺旋的取代结构结构，以及模拟螺旋介导的PPI中“热点”侧链位置的设计。表位模拟物的设计采用了基于结构的设计，重点关注热点残基在PPI界面上的位置。

• 可选用DMSO耐受的96/384孔板或2D 条形码编码管；
• 干粉蓝冰运输，DMSO溶液干冰运输；
• 排布：96孔板：1st & 12th 空白对照，384孔板：1st & 2nd & 23th & 24th空白对照。