Human Ecto-5'-nucleotidase (CD73) in complex with the AMPCP derivative A894 (compound 2n in publication) in the closed form (crystal form IV)

Human Ecto-5'-nucleotidase (CD73) in complex with the AMPCP derivative A894 (compound 2n in publication) in the closed form (crystal form IV) Descriptor: 5'-nucleotidase, ZINC ION, [(2~{R},3~{S},4~{R},5~{R})-5-[2-chloranyl-6-(cyclopentylamino)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxymethylphosphonic acid Authors: Scaletti, E, Strater, N. Deposit date: 2020-03-23 Release date: 2021-01-20 Last modified: 2024-11-06 Method: X-RAY DIFFRACTION (2.66 Å) Cite: Discovery of Potent and Selective Methylenephosphonic Acid CD73 Inhibitors. J.Med.Chem., 64, 2021

人源胞外5'-核苷酸酶（Human Ecto-5'-nucleotidase，CD73）与AMPCP衍生物A894（文献中编号为化合物2n）以闭合构象（晶体形式IV）结合的复合物。描述项：5'-核苷酸酶、锌离子（ZINC ION）、[(2R,3S,4R,5R)-5-[2-氯-6-(环戊基氨基)嘌呤-9-基]-3,4-二羟基四氢呋喃-2-基]甲氧基甲基膦酸。作者：Scaletti, E、Strater, N.。提交日期：2020-03-23；发布日期：2021-01-20；最后修改日期：2024-11-06。实验方法：X射线衍射（X-RAY DIFFRACTION，分辨率2.66埃）。引用文献：《强效选择性亚甲基膦酸类CD73抑制剂的发现》（Discovery of Potent and Selective Methylenephosphonic Acid CD73 Inhibitors），《药物化学杂志》（J.Med.Chem.），第64卷，2021年。