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Crystal structure of E.coli Phosphopantetheine Adenylyltransferase (PPAT/CoaD) in complex with 5-methoxy-2-methyl-1H-indole

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Protein Data Bank Japan2023-10-04 更新2026-03-21 收录
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Crystal structure of E.coli Phosphopantetheine Adenylyltransferase (PPAT/CoaD) in complex with 5-methoxy-2-methyl-1H-indole Descriptor: 5-methoxy-2-methyl-1H-indole, DIMETHYL SULFOXIDE, PYROPHOSPHATE 2-, ... Authors: Proudfoot, A.W, Bussiere, D, Lingel, A. Deposit date: 2017-10-03 Release date: 2017-12-27 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (1.981 Å) Cite: High-Confidence Protein-Ligand Complex Modeling by NMR-Guided Docking Enables Early Hit Optimization. J. Am. Chem. Soc., 139, 2017

大肠杆菌(E. coli)磷酸泛酰巯基乙胺腺苷酰转移酶(Phosphopantetheine Adenylyltransferase,简称PPAT/CoaD)与5-甲氧基-2-甲基-1H-吲哚的复合物晶体结构 配体信息:5-甲氧基-2-甲基-1H-吲哚、二甲基亚砜、焦磷酸根二阴离子(PYROPHOSPHATE 2-)等 作者:Proudfoot, A.W.、Bussiere, D.、Lingel, A. 提交日期:2017-10-03 发布日期:2017-12-27 最后修改日期:2023-10-04 实验方法:X射线衍射(X-RAY DIFFRACTION),分辨率1.981埃(Å) 引用文献:《通过核磁共振引导对接实现高可信度蛋白质-配体复合物建模以助力早期命中物优化》(High-Confidence Protein-Ligand Complex Modeling by NMR-Guided Docking Enables Early Hit Optimization),J. Am. Chem. Soc., 139, 2017
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2017-10-03
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