Docking Evaluation of the Interaction Between Green Tea Active Ingredient, l-Theanine and Human Serum Albumin

被引：5
|
作者：
Roslan, Amira Adlin [1 ]
Mohamad, Saharuddin B. [2 ]
Tayyab, Saad [1 ]
机构：
[1] Univ Malaya, Biochem Programme, Inst Biol Sci, Fac Sci, Kuala Lumpur 50603, Malaysia
[2] Univ Malaya, Bioinformat Programme, Inst Biol Sci, Fac Sci, Kuala Lumpur 50603, Malaysia
来源：
NATIONAL ACADEMY SCIENCE LETTERS-INDIA | 2021年 / 44卷 / 01期
关键词：
l-Theanine; Human serum albumin; Molecular docking; Cluster analysis; BINDING;
D O I：
10.1007/s40009-020-00949-5
中图分类号：
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号：
07 ; 0710 ; 09 ;
摘要：
Interaction of one of the green tea active ingredients, l-theanine with the major transport protein of human blood circulation, human serum albumin (HSA) was investigated using molecular docking analysis. Site-specific docking simulation suggested binding preference of l-theanine to Site 1 of HSA. The binding site is proposed to be a cleft surrounded by both polar and nonpolar residues. l-Theanine binds to the protein through hydrophobic interactions as well as hydrogen bonds formed between Lys residues (195 and 199) of HSA and l-theanine.
引用
收藏
页码：17 / 19
页数：3
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