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Effectiveness of Phosphate Groups in Noncovalent Interactions in Binary Adenosine Nucleotides/Phosphoserine Aqueous Systems

机译:磷酸基团在二元腺苷核苷酸/磷酸丝氨酸水溶液系统中非共价相互作用的有效性

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摘要

Adduct formation in binary systems of O-phospho-L-serine (Ser-P) with adenosine 5-monophosphate (AMP), adenosine 5-diphosphate (ADP) and adenosine 5-triphosphate (ATP), has been investigated. This study was performed in aqueous solutions using a potentiometric method with computer analysis of the data, together with 13C and 31P NMR spectroscopic measurements. The overall stability constants of the adducts and the equilibrium constants for their formation have been determined. Ion-dipole and ion-ion interactions have been established to occur in the identified noncovalent complexes. An analysis of the equilibrium constants of the reaction has allowed the determination of the effectiveness of the phosphate groups and donor atoms of heterocyclic rings for molecular complex formation. The potential reaction centers are the atoms N(1) and N(7) from the purine base, the phosphate group of the nucleotides, and the phosphate, carboxyl and amine groups from phosphorylated serine. Sites for the interactions in the bioligands have been found on the basis of an equilibrium constant study and an analysis of the changes in the signal positions of their NMR spectra.
机译:已经研究了O-磷酸-L-丝氨酸(Ser-P)与5-单磷酸腺苷(AMP),5-二磷酸腺苷(ADP)和5-三磷酸腺苷(ATP)的二元体系中的加合物形成。这项研究是使用电位计法在水溶液中进行数据的计算机分析以及13 C和31 P NMR光谱测量。确定了加合物的整体稳定性常数及其形成的平衡常数。离子-偶极和离子-离子相互作用已确定在已鉴定的非共价络合物中发生。通过对反应平衡常数的分析,可以确定磷酸酯基团和杂环供体原子对分子配合物形成的有效性。潜在的反应中心是来自嘌呤碱基的原子N(1)和N(7),核苷酸的磷酸基团以及磷酸化丝氨酸的磷酸基,羧基和胺基。在平衡常数研究和对其NMR光谱信号位置变化的分析的基础上,找到了生物配体中相互作用的位点。

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