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BU of 6qgq by Molmil

Crystal structure of APT1 C2S mutant bound to palmitic acid.
分子名称:	Acyl-protein thioesterase 1, GLYCEROL, PALMITIC ACID
著者	Audagnotto, M, Marcaida, M.J, Ho, S, Pojer, F, Van der Goot, G, Dal Peraro, M.
登録日	2019-01-12
公開日	2020-02-05
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2.601 Å)
主引用文献	Palmitoylated acyl protein thioesterase APT2 deforms membranes to extract substrate acyl chains. Nat.Chem.Biol., 2021

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BU of 6qgn by Molmil

Crystal structure of APT1 bound to 2-Bromopalmitate
分子名称:	2-Bromopalmitic acid, Acyl-protein thioesterase 1
著者	Marcaida, M.J, Audagnotto, M, Ho, S, Pojer, F, Van der Goot, G, Dal Peraro, M.
登録日	2019-01-12
公開日	2020-02-05
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2.099 Å)
主引用文献	Palmitoylated acyl protein thioesterase APT2 deforms membranes to extract substrate acyl chains. Nat.Chem.Biol., 2021

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BU of 6qgo by Molmil

Crystal structure of APT1 S119A mutant bound to palmitic acid.
分子名称:	Acyl-protein thioesterase 1, PALMITIC ACID
著者	Audagnotto, M, Marcaida, M.J, Ho, S, Pojer, F, Van der Goot, G, Dal Peraro, M.
登録日	2019-01-12
公開日	2020-02-05
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2.599 Å)
主引用文献	Palmitoylated acyl protein thioesterase APT2 deforms membranes to extract substrate acyl chains. Nat.Chem.Biol., 2021

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BU of 6qgs by Molmil

Crystal structure of APT1 bound to palmitic acid.
分子名称:	Acyl-protein thioesterase 1, CHLORIDE ION, PALMITIC ACID
著者	Audagnotto, M, Marcaida, M.J, Ho, S, Pojer, F, Van der Goot, G, Dal Peraro, M.
登録日	2019-01-12
公開日	2020-02-05
最終更新日	2024-01-24
実験手法	X-RAY DIFFRACTION (2.755 Å)
主引用文献	Palmitoylated acyl protein thioesterase APT2 deforms membranes to extract substrate acyl chains. Nat.Chem.Biol., 2021

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BU of 5ehr by Molmil

Non-receptor Protein Tyrosine Phosphatase SHP2 in Complex with Allosteric Inhibitor SHP099
分子名称:	6-(4-azanyl-4-methyl-piperidin-1-yl)-3-[2,3-bis(chloranyl)phenyl]pyrazin-2-amine, PHOSPHATE ION, Tyrosine-protein phosphatase non-receptor type 11
著者	Stams, T, Fodor, M.
登録日	2015-10-28
公開日	2016-06-29
最終更新日	2023-09-27
実験手法	X-RAY DIFFRACTION (1.7 Å)
主引用文献	Allosteric inhibition of SHP2 phosphatase inhibits cancers driven by receptor tyrosine kinases. Nature, 535, 2016

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BU of 7jvn by Molmil

Non-receptor Protein Tyrosine Phosphatase SHP2 in Complex with Allosteric Inhibitor Compound 24
分子名称:	6-(4-amino-4-methylpiperidin-1-yl)-3-[(2,3-dichlorophenyl)sulfanyl]pyrazin-2-amine, PHOSPHATE ION, Tyrosine-protein phosphatase non-receptor type 11
著者	Fodor, M, Stams, T.
登録日	2020-08-21
公開日	2020-09-23
最終更新日	2023-10-18
実験手法	X-RAY DIFFRACTION (1.917 Å)
主引用文献	Identification of TNO155, an Allosteric SHP2 Inhibitor for the Treatment of Cancer. J.Med.Chem., 63, 2020

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BU of 7jvm by Molmil

Non-receptor Protein Tyrosine Phosphatase SHP2 in Complex with Allosteric Inhibitor TNO155
分子名称:	(3S,4S)-8-{6-amino-5-[(2-amino-3-chloropyridin-4-yl)sulfanyl]pyrazin-2-yl}-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine, PHOSPHATE ION, Tyrosine-protein phosphatase non-receptor type 11
著者	Fodor, M, Stams, T.
登録日	2020-08-21
公開日	2020-09-23
最終更新日	2023-10-18
実験手法	X-RAY DIFFRACTION (2.166 Å)
主引用文献	Identification of TNO155, an Allosteric SHP2 Inhibitor for the Treatment of Cancer. J.Med.Chem., 63, 2020

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BU of 5ehp by Molmil

Non-receptor Protein Tyrosine Phosphatase SHP2 in Complex with Allosteric Inhibitor SHP836
分子名称:	5-[2,3-bis(chloranyl)phenyl]-2-[(3~{R},5~{S})-3,5-dimethylpiperazin-1-yl]pyrimidin-4-amine, PHOSPHATE ION, Tyrosine-protein phosphatase non-receptor type 11
著者	Stams, T, Fodor, M.
登録日	2015-10-28
公開日	2016-07-06
最終更新日	2023-09-27
実験手法	X-RAY DIFFRACTION (1.85 Å)
主引用文献	Allosteric Inhibition of SHP2: Identification of a Potent, Selective, and Orally Efficacious Phosphatase Inhibitor. J.Med.Chem., 59, 2016

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BU of 5fa5 by Molmil

Crystal Structure of PRMT5:MEP50 in complex with MTA and H4 peptide
分子名称:	5'-DEOXY-5'-METHYLTHIOADENOSINE, Histone H4, Methylosome protein 50, ...
著者	Sprague, E.R, McNamara, J.T.
登録日	2015-12-10
公開日	2016-02-24
最終更新日	2023-09-27
実験手法	X-RAY DIFFRACTION (2.34 Å)
主引用文献	Disordered methionine metabolism in MTAP/CDKN2A-deleted cancers leads to dependence on PRMT5. Science, 351, 2016

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BU of 7law by Molmil

crystal structure of GITR complex with GITR-L
分子名称:	2-acetamido-2-deoxy-beta-D-glucopyranose, Tumor necrosis factor ligand superfamily member 18, Tumor necrosis factor receptor superfamily member 18
著者	Longenecker, K.L, Rogers, B, Bigelow, L, Judge, R.A, Alvarez, H.
登録日	2021-01-07
公開日	2022-03-09
最終更新日	2023-10-18
実験手法	X-RAY DIFFRACTION (2.752 Å)
主引用文献	An anti-PD-1-GITR-L bispecific agonist induces GITR clustering-mediated T cell activation for cancer immunotherapy. Nat Cancer, 3, 2022

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BU of 2rma by Molmil

Crystal structures of cyclophilin A complexed with cyclosporin A and N-methyl-4-[(E)-2-butenyl]-4,4-dimethylthreonine cyclosporin A
分子名称:	CYCLOSPORIN A, PEPTIDYL-PROLYL CIS-TRANS ISOMERASE
著者	Ke, H, Mayrose, D.
登録日	1994-01-07
公開日	1995-02-07
最終更新日	2017-11-01
実験手法	X-RAY DIFFRACTION (2.1 Å)
主引用文献	Crystal Structures of Cyclophilin a Complexed with Cyclosporin a and N-Methyl-4-[(E)-2-Butenyl]-4,4-Dimethylthreonine Cyclosporin A. Structure, 2, 1994

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BU of 2rmb by Molmil

Crystal structures of cyclophilin A complexed with cyclosporin A and N-methyl-4-[(E)-2-butenyl]-4,4-dimethylthreonine cyclosporin A
分子名称:	CYCLOSPORIN A, PEPTIDYL-PROLYL CIS-TRANS ISOMERASE
著者	Ke, H, Mayrose, D.
登録日	1994-01-07
公開日	1995-02-07
最終更新日	2017-11-01
実験手法	X-RAY DIFFRACTION (2.1 Å)
主引用文献	Crystal Structures of Cyclophilin a Complexed with Cyclosporin a and N-Methyl-4-[(E)-2-Butenyl]-4,4-Dimethylthreonine Cyclosporin A. Structure, 2, 1994

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BU of 3g4o by Molmil

Crystal structure of the activated aerolysin mutant H132N
分子名称:	Aerolysin
著者	Pernot, L, Schiltz, M, van der Goot, G.
登録日	2009-02-04
公開日	2010-02-09
最終更新日	2023-11-01
実験手法	X-RAY DIFFRACTION (2.3 Å)
主引用文献	Dual chaperone role of the C-terminal propeptide in folding and oligomerization of the pore-forming toxin aerolysin. Plos Pathog., 7, 2011

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BU of 3g4n by Molmil

Crystal structure of the activated aerolysin mutant H132D
分子名称:	Aerolysin
著者	Pernot, L, Schiltz, M, van der Goot, G.
登録日	2009-02-04
公開日	2010-02-09
最終更新日	2023-11-01
実験手法	X-RAY DIFFRACTION (2.1 Å)
主引用文献	Dual chaperone role of the C-terminal propeptide in folding and oligomerization of the pore-forming toxin aerolysin. Plos Pathog., 7, 2011

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BU of 2jo4 by Molmil

Tetrameric structure of KIA7 peptide
分子名称:	KIA7
著者	Lopez de la Osa, J, Gonzalez, C, Laurents, D.V, Chakrabartty, A, Bateman, D.A.
登録日	2007-02-21
公開日	2007-09-18
最終更新日	2023-12-20
実験手法	SOLUTION NMR
主引用文献	Getting specificity from simplicity in putative proteins from the prebiotic earth. Proc.Natl.Acad.Sci.Usa, 104, 2007

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BU of 2jo5 by Molmil

Tetrameric structure of KIA7F peptide
分子名称:	KIA7F
著者	Lopez de la Osa, J, Gonzalez, C, Laurents, D.V, Chakrabartty, A, Bateman, D.A.
登録日	2007-02-21
公開日	2007-09-18
最終更新日	2023-12-20
実験手法	SOLUTION NMR
主引用文献	Getting specificity from simplicity in putative proteins from the prebiotic earth. Proc.Natl.Acad.Sci.Usa, 104, 2007

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