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3F2A
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CRYSTAL STRUCTURE OF HUMAN PIM-1 IN COMPLEX WITH DAPPA
分子名称:Proto-oncogene serine/threonine-protein kinase Pim-1, (2E)-3-{3-[6-(4-methyl-1,4-diazepan-1-yl)pyrazin-2-yl]phenyl}prop-2-enoic acid, MAGNESIUM ION
著者Qian, K.
登録日2008-10-29
公開日2009-03-10
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Hit to lead account of the discovery of a new class of inhibitors of Pim kinases and crystallographic studies revealing an unusual kinase binding mode.
J.Med.Chem., 52, 2009
6A4I
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CRYSTAL STRUCTURE OF HUMAN TDO INHIBITOR COMPLEX
分子名称:Tryptophan 2,3-dioxygenase, PROTOPORPHYRIN IX CONTAINING FE, 1-(6-chloro-1H-indazol-4-yl)cyclohexan-1-ol, ...
著者Fu, G., Wang, J., Luo, G., Wu, G., Qian, K.
登録日2018-06-20
公開日2018-07-18
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献Crystal Structure of human TDO inhibitor complex
To Be Published
3CTQ
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STRUCTURE OF MAP KINASE P38 IN COMPLEX WITH A 1-O-TOLYL-1,2,3-TRIAZOLE-4-CARBOXAMIDE
分子名称:Mitogen-activated protein kinase 14, N-benzyl-1-[5-({5-tert-butyl-2-methoxy-3-[(methylsulfonyl)amino]phenyl}carbamoyl)-2-methylphenyl]-1H-1,2,3-triazole-4-carboxamide
著者Qian, K.
登録日2008-04-14
公開日2008-05-27
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Structure-based design and subsequent optimization of 2-tolyl-(1,2,3-triazol-1-yl-4-carboxamide) inhibitors of p38 MAP kinase.
Bioorg.Med.Chem.Lett., 18, 2008
4G1N
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PKM2 IN COMPLEX WITH AN ACTIVATOR
分子名称:Pyruvate kinase isozymes M1/M2, OXALATE ION, MAGNESIUM ION, ...
著者Kung, C., Hixon, J., Dang, L., DeLaBarre, B., Qian, K.C.
登録日2012-07-10
公開日2012-10-10
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Small Molecule Activation of PKM2 in Cancer Cells Induces Serine Auxotrophy.
Chem.Biol., 19, 2012
4JA8
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COMPLEX OF MITOCHONDRIAL ISOCITRATE DEHYDROGENASE R140Q MUTANT WITH AGI-6780 INHIBITOR
分子名称:Isocitrate dehydrogenase [NADP], mitochondrial, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Wei, W., Chen, L., Wu, M., Jiang, F., Travins, J., Qian, K., DeLaBarre, B.
登録日2013-02-18
公開日2013-04-10
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Targeted inhibition of mutant IDH2 in leukemia cells induces cellular differentiation.
Science, 340, 2013
5V2N
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CRYSTAL STRUCTURE OF APO HUMAN SETD8
分子名称:N-lysine methyltransferase KMT5A, 1,2-ETHANEDIOL
著者Skene, R.J.
登録日2017-03-05
公開日2018-03-07
最終更新日2019-06-12
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The dynamic conformational landscape of the protein methyltransferase SETD8.
Elife, 8, 2019
6BOZ
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STRUCTURE OF HUMAN SETD8 IN COMPLEX WITH COVALENT INHIBITOR MS4138
分子名称:N-lysine methyltransferase KMT5A, 1,2-ETHANEDIOL, N-(3-{[7-(2-aminoethoxy)-6-methoxy-2-(pyrrolidin-1-yl)quinazolin-4-yl]amino}propyl)prop-2-enamide
著者Babault, N., Anqi, M., Jin, J.
登録日2017-11-21
公開日2019-05-01
最終更新日2019-05-29
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献The dynamic conformational landscape of the protein methyltransferase SETD8.
Elife, 8, 2019
5MU1
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UDP-GLUCOSE GLYCOPROTEIN GLUCOSYLTRANSFERASE FROM CHAETOMIUM THERMOPHILUM SOAKED WITH K2PTI6
分子名称:UDP-glucose-glycoprotein glucosyltransferase-like protein, IODIDE ION, PLATINUM (II) ION, ...
著者Roversi, P., Caputo, A.T., Hill, J., Alonzi, D.S., Zitzmann, N.
登録日2017-01-11
公開日2017-07-26
最終更新日2017-08-16
実験手法X-RAY DIFFRACTION (3.48 Å)
主引用文献Interdomain conformational flexibility underpins the activity of UGGT, the eukaryotic glycoprotein secretion checkpoint.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
5MZO
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UDP-GLUCOSE GLYCOPROTEIN GLUCOSYLTRANSFERASE FROM CHAETOMIUM THERMOPHILUM (OPEN CONFORMATION)
分子名称:UDP-glucose-glycoprotein glucosyltransferase-like protein, N-ACETYL-D-GLUCOSAMINE, BETA-D-MANNOSE, ...
著者Roversi, P., Caputo, A.T., Hill, J., Alonzi, D.S., Zitzmann, N.
登録日2017-02-01
公開日2017-07-26
最終更新日2017-08-16
実験手法X-RAY DIFFRACTION (3.48 Å)
主引用文献Interdomain conformational flexibility underpins the activity of UGGT, the eukaryotic glycoprotein secretion checkpoint.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
5N2J
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UDP-GLUCOSE GLYCOPROTEIN GLUCOSYLTRANSFERASE FROM CHAETOMIUM THERMOPHILUM (CLOSED FORM)
分子名称:UDP-glucose-glycoprotein glucosyltransferase-like protein, N-ACETYL-D-GLUCOSAMINE, BETA-D-MANNOSE, ...
著者Roversi, P., Caputo, A.T., Hill, J., Alonzi, D.S., Zitzmann, N.
登録日2017-02-07
公開日2017-07-26
最終更新日2017-11-29
実験手法X-RAY DIFFRACTION (4.4 Å)
主引用文献Interdomain conformational flexibility underpins the activity of UGGT, the eukaryotic glycoprotein secretion checkpoint.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
5NV4
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UDP-GLUCOSE GLYCOPROTEIN GLUCOSYLTRANSFERASE FROM CHAETOMIUM THERMOPHILUM DOUBLE MUTANT D611C:G1050C
分子名称:UDP-glucose-glycoprotein glucosyltransferase-like protein, N-ACETYL-D-GLUCOSAMINE, BETA-D-MANNOSE, ...
著者Roversi, P., Caputo, A.T., Hill, J., Alonzi, D.S., Zitzmann, N.
登録日2017-05-03
公開日2017-07-26
最終更新日2017-08-16
実験手法X-RAY DIFFRACTION (2.78 Å)
主引用文献Interdomain conformational flexibility underpins the activity of UGGT, the eukaryotic glycoprotein secretion checkpoint.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017