Structure of P. aeruginosa LpxC with compound 18d: (2R)-N-Hydroxy-4-(6-((1-(hydroxymethyl)cyclopropyl)buta-1,3-diyn-1-yl)-3-oxo-1H-pyrrolo[1,2-c]imidazol-2(3H)-yl)-2-methyl-2-(methylsulfonyl)butanamide

Structure of P. aeruginosa LpxC with compound 18d: (2R)-N-Hydroxy-4-(6-((1-(hydroxymethyl)cyclopropyl)buta-1,3-diyn-1-yl)-3-oxo-1H-pyrrolo[1,2-c]imidazol-2(3H)-yl)-2-methyl-2-(methylsulfonyl)butanamide Descriptor: (2~{R})-4-[6-[4-[1-(hydroxymethyl)cyclopropyl]buta-1,3-diynyl]-3-oxidanylidene-1~{H}-pyrrolo[1,2-c]imidazol-2-yl]-2-methyl-2-methylsulfonyl-~{N}-oxidanyl-butanamide, UDP-3-O-acyl-N-acetylglucosamine deacetylase, ZINC ION Authors: Surivet, J.-P, Panchaud, P, Specklin, J.-L, Diethelm, S, Blumstein, A.-C, Gauvin, J.-C, Jacob, L, Masse, F, Mathieu, G, Mirre, A, Schmitt, C, Enderlin-Paput, M, Lange, R, Bur, D, Tidten-Luksch, N, Gnerre, C, Seeland, S, Hermann, C, Locher, H.H, Seiler, P, Mac Sweeney, A, Hubschwerlen, C, Ritz, D, Rueedi, G. Deposit date: 2018-11-09 Release date: 2019-12-18 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (2.251 Å) Cite: Discovery of Novel Inhibitors of LpxC Displaying Potent in Vitro Activity against Gram-Negative Bacteria. J.Med.Chem., 63, 2020

铜绿假单胞菌（P. aeruginosa）LpxC与化合物18d的晶体结构：(2R)-N-羟基-4-(6-((1-(羟甲基)环丙基)丁-1,3-二炔-1-基)-3-氧代-1H-吡咯并[1,2-c]咪唑-2(3H)-基)-2-甲基-2-(甲磺酰基)丁酰胺。描述符：(2R)-4-[6-[4-[1-(羟甲基)环丙基]丁-1,3-二炔基]-3-氧代-1H-吡咯并[1,2-c]咪唑-2-基]-2-甲基-2-甲磺酰基-N-羟基丁酰胺，UDP-3-O-酰基-N-乙酰葡糖胺脱乙酰酶（UDP-3-O-acyl-N-acetylglucosamine deacetylase），锌离子。作者：Surivet J.-P、Panchaud P、Specklin J.-L、Diethelm S、Blumstein A.-C、Gauvin J.-C、Jacob L、Masse F、Mathieu G、Mirre A、Schmitt C、Enderlin-Paput M、Lange R、Bur D、Tidten-Luksch N、Gnerre C、Seeland S、Hermann C、Locher H.H、Seiler P、Mac Sweeney A、Hubschwerlen C、Ritz D、Rueedi G。存放日期：2018-11-09；发布日期：2019-12-18；最后修改日期：2024-01-24。测定方法：X射线衍射（分辨率2.251 Å）。引用文献：《发现新型LpxC抑制剂，对革兰氏阴性菌具有强效体外活性》，《药物化学杂志（J.Med.Chem.）》，第63卷，2020年。