Investigation Binding Patterns of Human Carboxylesterase I (hCES I) with Broad Substrates by MD Simulations
文献类型：期刊论文
| 作者 | Chu, Huiying1; Min, Hanyi2,3; Zhang, Mingbo4; Shen, Hujun1; Li, Guohui1 |
| 刊名 | current topics in medicinal chemistry
 |
| 出版日期 | 2013-05-01 |
| 卷号 | 13期号:10页码:1222-1233 |
| 关键词 | hCES1 binding pattern molecular simulations |
| 产权排序 | 待补充 |
| 通讯作者 | hanyi min ; 李国辉 |
| 合作状况 | 英 |
| 英文摘要 | human carboxylesterase i (hces 1) plays an important role in the metabolism and activation of prodrugs, such as, the hydrolysis of a variety of drugs of prodrugs featuring an ester, amide or carbamate function. the bindings of the substrates of different lengths and cocaine to hces1 at two different binding sites, catalytic site and z-site, were studies through md simulations. for each case, the correlation analysis has been performed to explore the binding patterns of a broad range of substrates binding to the hces1. |
| WOS标题词 | science & technology ; life sciences & biomedicine |
| 学科主题 | 物理化学 |
| 类目[WOS] | chemistry, medicinal |
| 研究领域[WOS] | pharmacology & pharmacy |
| 关键词[WOS] | m2 proton channel ; human liver carboxylesterase ; protease cleavage sites ; influenza-a virus ; sequential evolution information ; predicting signal peptides ; fusing functional domain ; tertiary structure ; web-server ; mammalian carboxylesterases |
| 收录类别 | SCI |
| 资助信息 | 1，1 |
| 原文出处 | 1233 |
| 语种 | 英语 |
| WOS记录号 | WOS:000319974500009 |
| 公开日期 | 2014-09-11 |
| 源URL | [http://159.226.238.44/handle/321008/119483]  |
| 专题 | 大连化学物理研究所_中国科学院大连化学物理研究所 |
| 作者单位 | 1.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Lab Mol Modeling & Design, Dalian, Liaoning Provin, Peoples R China 2.Chinese Acad Med Sci, Peking Union Med Coll Hosp, Dept Ophthalmol, Beijing 100730, Peoples R China 3.Peking Union Med Coll, Beijing 100730, Peoples R China 4.Liaoning Univ Tradit Chinese Med, Coll Pharm, Dalian 116600, Liaoning Provin, Peoples R China |
| 推荐引用方式 GB/T 7714 | Chu, Huiying,Min, Hanyi,Zhang, Mingbo,et al. Investigation Binding Patterns of Human Carboxylesterase I (hCES I) with Broad Substrates by MD Simulations[J]. current topics in medicinal chemistry,2013,13(10):1222-1233. |
| APA | Chu, Huiying,Min, Hanyi,Zhang, Mingbo,Shen, Hujun,&Li, Guohui.(2013).Investigation Binding Patterns of Human Carboxylesterase I (hCES I) with Broad Substrates by MD Simulations.current topics in medicinal chemistry,13(10),1222-1233. |
| MLA | Chu, Huiying,et al."Investigation Binding Patterns of Human Carboxylesterase I (hCES I) with Broad Substrates by MD Simulations".current topics in medicinal chemistry 13.10(2013):1222-1233. |
入库方式： OAI收割
来源：大连化学物理研究所
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