BioNMR Laboratory, Department of Inorganic and Organic Chemistry, Universitat de Barcelona, Baldiri Reixac, 10-12, 08028 Barcelona, Spain.
IDP Discovery Pharma, S.L. Barcelona Science Park, Baldiri Reixac, 10-12, 08028 Barcelona, Spain.
Biosensors (Basel). 2022 Feb 4;12(2):96. doi: 10.3390/bios12020096.
In signaling proteins, intrinsically disordered regions often represent regulatory elements, which are sensitive to environmental effects, ligand binding, and post-translational modifications. The conformational space sampled by disordered regions can be affected by environmental stimuli and these changes trigger, vis a vis effector domain, downstream processes. The disordered nature of these regulatory elements enables signal integration and graded responses but prevents the application of classical approaches for drug screening based on the existence of a fixed three-dimensional structure. We have designed a genetically encodable biosensor for the N-terminal regulatory element of the c-Src kinase, the first discovered protooncogene and lead representative of the Src family of kinases. The biosensor is formed by two fluorescent proteins forming a FRET pair fused at the two extremes of a construct including the SH4, unique and SH3 domains of Src. An internal control is provided by an engineered proteolytic site allowing the generation of an identical mixture of the disconnected fluorophores. We show FRET variations induced by ligand binding. The biosensor has been used for a high-throughput screening of a library of 1669 compounds with seven hits confirmed by NMR.
在信号蛋白中,内源性无序区域通常代表调节元件,这些元件对环境效应、配体结合和翻译后修饰敏感。无序区域所采样的构象空间可能受到环境刺激的影响,这些变化触发下游过程相对于效应域。这些调节元件的无序性质能够实现信号整合和分级响应,但阻止了基于固定三维结构的经典药物筛选方法的应用。我们设计了一种可遗传编码的 c-Src 激酶 N 端调节元件生物传感器,c-Src 激酶是第一个被发现的原癌基因,也是 Src 激酶家族的主要代表。该生物传感器由两个荧光蛋白组成,它们在包括Src 的独特 SH4 和 SH3 结构域的构建体的两个极端融合形成 FRET 对。一个工程化的蛋白水解位点提供了内部对照,允许产生相同的分离荧光团混合物。我们展示了配体结合诱导的 FRET 变化。该生物传感器已用于对 1669 种化合物文库进行高通量筛选,其中 7 种化合物通过 NMR 得到确认。