CATION BINDING TO BIOMOLECULES .6. SCF ABINITIO (PSEUDOPOTENTIAL) COMPUTATIONS ON THE INTERACTION OF ZN2+ WITH THE PURINE AND PYRIMIDINE-BASES OF THE NUCLEIC-ACIDS

被引:25
作者
PULLMAN, A
EBBESEN, T
RHOLAM, M
机构
[1] Laboratoire de Biochimie Théorique associé au C.N.R.S., Institut de Biologie Physico-Chimique, Paris, F-75005, 13, rue P. et M. Curie
来源
THEORETICA CHIMICA ACTA | 1979年 / 51卷 / 03期
关键词
Zn[!sup]2+[!/sup] binding to nucleic acid bases;
D O I
10.1007/BF00572931
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The binding of Zn2+ to the purine and pyrimidine bases of the nucleic acids was studied by SCF ab initio (pseudopotential) computations. The order of affinity of the bases is guanine ≃ cytosine > adenine ≫ uracil. Many geometrical features of the binding are similar to those observed previously in the interaction of the bases with Na+. A new feature is the possibility of chelation by Zn2+ between N7 and the rotated NH2 group of adenine. © 1979 Springer-Verlag.
引用
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页码:247 / 254
页数:8
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