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Rapid Mechanistic Evaluation and Parameter Estimation of Putative Inhibitors in a Single-Step Progress-Curve Analysis: The Case of Horse Butyrylcholinesterase

机译:单步进展曲线分析中推定抑制剂的快速机理评估和参数估计:马丁酰胆碱酯酶的案例

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Highly efficient and rapid lead compound evaluation for estimation of inhibition parameters and type of inhibition is proposed. This is based on a single progress-curve measurement in the presence of each candidate compound, followed by the simultaneous analysis of all of these curves using the ENZO enzyme kinetics suite, which can be implemented as a web application. In the first step, all of the candidate ligands are tested as competitive inhibitors. Where the theoretical curves do not correspond to the experimental data, minimal additional measurements are added, with subsequent processing according to modified reaction mechanisms. View Full-Text
机译:提出了一种高效,快速的铅化合物评估方法,用于评估抑制参数和抑制类型。这是基于在每种候选化合物的存在下进行的单个曲线的测量,然后使用ENZO酶动力学套件同时分析所有这些曲线,可以将其作为Web应用程序实施。第一步,将所有候选配体作为竞争性抑制剂进行测试。如果理论曲线与实验数据不符,则添加最少的附加测量值,并根据修改后的反应机理进行后续处理。查看全文

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