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BU of 4jrv by Molmil

Crystal structure of EGFR kinase domain in complex with compound 4c
分子名称:	4-(dimethylamino)-N-[3-(4-{[(1S)-2-hydroxy-1-phenylethyl]amino}-6-phenylfuro[2,3-d]pyrimidin-5-yl)phenyl]butanamide, Epidermal growth factor receptor
著者	Peng, Y.H, Wu, J.S.
登録日	2013-03-22
公開日	2013-06-19
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (2.8 Å)
主引用文献	Protein Kinase Inhibitor Design by Targeting the Asp-Phe-Gly (DFG) Motif: The Role of the DFG Motif in the Design of Epidermal Growth Factor Receptor Inhibitors J.Med.Chem., 56, 2013

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BU of 4jq7 by Molmil

Crystal structure of EGFR kinase domain in complex with compound 2a
分子名称:	(2S)-2-[(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)amino]-2-phenylethanol, Epidermal growth factor receptor
著者	Peng, Y.H, Wu, J.S.
登録日	2013-03-20
公開日	2013-06-19
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (2.73 Å)
主引用文献	Protein Kinase Inhibitor Design by Targeting the Asp-Phe-Gly (DFG) Motif: The Role of the DFG Motif in the Design of Epidermal Growth Factor Receptor Inhibitors J.Med.Chem., 56, 2013

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BU of 2d2r by Molmil

Crystal structure of Helicobacter pylori Undecaprenyl Pyrophosphate Synthase
分子名称:	Undecaprenyl Pyrophosphate Synthase
著者	Kuo, C.J, Guo, R.T, Chen, C.L, Ko, T.P, Cheng, Y.S, Cheng, Y.L, Liang, P.H, Wang, A.H.-J.
登録日	2005-09-16
公開日	2006-09-26
最終更新日	2023-10-25
実験手法	X-RAY DIFFRACTION (1.88 Å)
主引用文献	Structure-based inhibitors exhibit differential activities against Helicobacter pylori and Escherichia coli undecaprenyl pyrophosphate synthases. J.Biomed.Biotechnol., 2008, 2008

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BU of 2dtn by Molmil

Crystal structure of Helicobacter pylori undecaprenyl pyrophosphate synthase complexed with pyrophosphate
分子名称:	DIPHOSPHATE, undecaprenyl pyrophosphate synthase
著者	Guo, R.T, Kuo, C.J, Chen, C.L, Ko, T.P, Liang, P.H, Wang, A.H.-J.
登録日	2006-07-13
公開日	2007-06-26
最終更新日	2023-10-25
実験手法	X-RAY DIFFRACTION (2.5 Å)
主引用文献	Biochemical characterization, crystal structure, and inhibitors of Helicobacter pylori undecaprenyl pyrophosphate synthase To be Published

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BU of 4hys by Molmil

Crystal structure of JNK1 in complex with JIP1 peptide and 4-(4-Indazol-1-yl-pyrimidin-2-ylamino)-cyclohexan
分子名称:	C-Jun-amino-terminal kinase-interacting protein 1, Mitogen-activated protein kinase 8, trans-4-{[4-(1H-indazol-1-yl)pyrimidin-2-yl]amino}cyclohexanol
著者	Kuglstatter, A, Janson, C.
登録日	2012-11-14
公開日	2013-10-30
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.415 Å)
主引用文献	Development of amino-pyrimidine inhibitors of c-Jun N-terminal kinase (JNK): kinase profiling guided optimization of a 1,2,3-benzotriazole lead. Bioorg.Med.Chem.Lett., 23, 2013

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BU of 4hyu by Molmil

Crystal structure of JNK1 in complex with JIP1 peptide and 4-{4-[4-(3-Methanesulfonyl-propoxy)-indazol-1-yl]-pyrimidin-2-ylamino}-cyclohexan
分子名称:	C-Jun-amino-terminal kinase-interacting protein 1, Mitogen-activated protein kinase 8, trans-4-[(4-{4-[3-(methylsulfonyl)propoxy]-1H-indazol-1-yl}pyrimidin-2-yl)amino]cyclohexanol
著者	Kuglstatter, A, Ghate, M.
登録日	2012-11-14
公開日	2013-10-30
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.152 Å)
主引用文献	Development of amino-pyrimidine inhibitors of c-Jun N-terminal kinase (JNK): kinase profiling guided optimization of a 1,2,3-benzotriazole lead. Bioorg.Med.Chem.Lett., 23, 2013

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BU of 3h59 by Molmil

Hepatitis C virus polymerase NS5B with thiazine inhibitor 2
分子名称:	N-{3-[(5S)-5-(1,1-dimethylpropyl)-1-(4-fluoro-3-methylbenzyl)-4-hydroxy-2-oxo-2,5-dihydro-1H-pyrrol-3-yl]-1,1-dioxido-4H-1,4-benzothiazin-7-yl}methanesulfonamide, RNA-directed RNA polymerase
著者	Harris, S.F, Ghate, M.
登録日	2009-04-21
公開日	2009-09-08
最終更新日	2011-07-13
実験手法	X-RAY DIFFRACTION (2.1 Å)
主引用文献	Non-nucleoside inhibitors of HCV polymerase NS5B. Part 3: synthesis and optimization studies of benzothiazine-substituted tetramic acids Bioorg.Med.Chem.Lett., 19, 2009

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