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BU of 5egm by Molmil

Development of a novel tricyclic class of potent and selective FIXa inhibitors
分子名称:	2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, 2-chloranyl-~{N}-[(7~{S})-2-methyl-7-phenyl-10-(1~{H}-1,2,3,4-tetrazol-5-yl)-8,9-dihydro-6~{H}-pyrido[1,2-a]indol-7-yl]-4-(1,2,4-triazol-4-yl)benzamide, Coagulation factor IX, ...
著者	Meng, D, Andre, P, Bateman, T.J, Berger, R, Chen, Y, Desai, K, Dewnani, S, Ellsworth, K, Feng, D, Geissler, W.M, Guo, L, Hruza, A, Jian, T, Li, H, Parker, D.L, Reichert, P, Sherer, E.C, Smith, C.J, Sonatore, L.M, Tschirret-Guth, R, Wu, J, Xu, J, Zhang, T, Campeau, L, Orr, R, Poirier, M, McCabe-Dunn, j, Araki, K, Nishimura, T, Sakurada, I, Hirabayashi, T, Wood, H.B.
登録日	2015-10-27
公開日	2015-11-18
最終更新日	2023-09-27
実験手法	X-RAY DIFFRACTION (1.841 Å)
主引用文献	Development of a novel tricyclic class of potent and selective FIXa inhibitors. Bioorg.Med.Chem.Lett., 25, 2015

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BU of 4f9m by Molmil

Crystal structure of the PPARgamma-LBD complexed with a cercosporamide derivative modulator
分子名称:	(9aS)-8-acetyl-N-[(2-ethyl-4-fluoronaphthalen-1-yl)methyl]-1,7-dihydroxy-3-methoxy-9a-methyl-9-oxo-9,9a-dihydrodibenzo[b,d]furan-4-carboxamide, Peroxisome proliferator-activated receptor gamma, peptide from Nuclear receptor coactivator 1
著者	Matsui, Y, Hanzawa, H.
登録日	2012-05-19
公開日	2012-08-08
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (1.9 Å)
主引用文献	Synthesis and biological evaluation of novel (-)-cercosporamide derivatives as potent selective PPARg modulators Eur.J.Med.Chem., 54, 2012

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BU of 4j19 by Molmil

Structure of a novel telomere repeat binding protein bound to DNA
分子名称:	CHLORIDE ION, DNA (5'-D(CPTPGPTPTPAPGPGPGPTPTPAPGPGPGPTPTPAPG)-3'), DNA (5'-D(TPCPTPAPAPCPCPCPTPAPAPCPCPCPTPAPAPCPA)-3'), ...
著者	Kappei, D, Butter, F, Benda, C, Scheibe, M, Draskovic, I, Stevense, M, Lopes Novo, C, Basquin, C, Krastev, D.B, Kittler, R, Jessberger, R, Londono-Vallejo, A.J, Mann, M, Buchholz, F.
登録日	2013-02-01
公開日	2013-05-29
最終更新日	2023-09-20
実験手法	X-RAY DIFFRACTION (2.9 Å)
主引用文献	HOT1 is a mammalian direct telomere repeat-binding protein contributing to telomerase recruitment. Embo J., 32, 2013

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BU of 3lmp by Molmil

Crystal structure of the PPARgamma-LBD complexed with a cercosporamide derivative modulator
分子名称:	(9aS)-8-acetyl-1,7-dihydroxy-3-methoxy-9a-methyl-N-(1-naphthylmethyl)-9-oxo-9,9a-dihydrodibenzo[b,d]furan-4-carboxamide, Peptide of Nuclear receptor coactivator 1, Peroxisome proliferator-activated receptor gamma
著者	Matsui, Y, Hanzawa, H.
登録日	2010-01-31
公開日	2010-04-14
最終更新日	2023-11-01
実験手法	X-RAY DIFFRACTION (1.9 Å)
主引用文献	Discovery of a novel selective PPARgamma modulator from (-)-Cercosporamide derivatives Bioorg.Med.Chem.Lett., 20, 2010

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BU of 4zae by Molmil

Development of a novel class of potent and selective FIXa inhibitors
分子名称:	2,6-dichloro-N-[(2R)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-phenylethyl]-4-(4H-1,2,4-triazol-4-yl)benzamide, 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, Coagulation factor IX, ...
著者	Hruza, A, Reichert, P.
登録日	2015-04-13
公開日	2015-06-03
最終更新日	2023-09-27
実験手法	X-RAY DIFFRACTION (1.86 Å)
主引用文献	Development of a novel class of potent and selective FIXa inhibitors. Bioorg.Med.Chem.Lett., 25, 2015

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BU of 5gow by Molmil

Solution structure of the complex between DP1 acidic region and TFIIH p62 PH domain
分子名称:	DP1, General transcription factor IIH subunit 1
著者	Okuda, M, Nishimura, Y.
登録日	2016-07-29
公開日	2016-12-07
最終更新日	2024-05-01
実験手法	SOLUTION NMR
主引用文献	The Interaction Mode of the Acidic Region of the Cell Cycle Transcription Factor DP1 with TFIIH J. Mol. Biol., 428, 2016

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BU of 5z5s by Molmil

Crystal structure of the PPARgamma-LBD complexed with compound 13ab
分子名称:	3-{[6-(4-chloro-3-fluorophenoxy)-1-methyl-1H-benzimidazol-2-yl]methoxy}benzoic acid, CHLORIDE ION, Peptide from Peroxisome proliferator-activated receptor gamma coactivator 1-alpha, ...
著者	Matsui, Y, Hanzawa, H.
登録日	2018-01-19
公開日	2018-10-17
最終更新日	2023-11-22
実験手法	X-RAY DIFFRACTION (1.8 Å)
主引用文献	Discovery of DS-6930, a potent selective PPAR gamma modulator. Part I: Lead identification. Bioorg. Med. Chem., 26, 2018

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BU of 5z6s by Molmil

Crystal structure of the PPARgamma-LBD complexed with compound DS-6930
分子名称:	3-[[6-(3,5-dimethylpyridin-2-yl)oxy-1-methyl-benzimidazol-2-yl]methoxy]benzoic acid, CHLORIDE ION, Peptide from Peroxisome proliferator-activated receptor gamma coactivator 1-alpha, ...
著者	Matsui, Y, Hanzawa, H.
登録日	2018-01-25
公開日	2018-10-17
最終更新日	2023-11-22
実験手法	X-RAY DIFFRACTION (1.8 Å)
主引用文献	Discovery of DS-6930, a potent selective PPAR gamma modulator. Part II: Lead optimization. Bioorg. Med. Chem., 26, 2018

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BU of 6izn by Molmil

Crystal structure of the PPARgamma-LBD complexed with compound 3g
分子名称:	3-[[6-(2,6-dimethylpyridin-3-yl)oxy-7-fluoranyl-1-methyl-benzimidazol-2-yl]methoxy]benzoic acid, Peptide from Peroxisome proliferator-activated receptor gamma coactivator 1-alpha, Peroxisome proliferator-activated receptor gamma
著者	Matsui, Y, Hanzawa, H.
登録日	2018-12-20
公開日	2019-03-27
最終更新日	2023-11-22
実験手法	X-RAY DIFFRACTION (1.75 Å)
主引用文献	Structure-Activity Relationship Studies of 3- or 4-Pyridine Derivatives of DS-6930. Acs Med.Chem.Lett., 10, 2019

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BU of 6izm by Molmil

Crystal structure of the PPARgamma-LBD complexed with compound 1l
分子名称:	3-[[6-(2,6-dimethylpyridin-3-yl)oxy-1-methyl-benzimidazol-2-yl]methoxy]benzoic acid, Peptide from Peroxisome proliferator-activated receptor gamma coactivator 1-alpha, Peroxisome proliferator-activated receptor gamma
著者	Matsui, Y, Hanzawa, H.
登録日	2018-12-20
公開日	2019-03-27
最終更新日	2023-11-22
実験手法	X-RAY DIFFRACTION (1.8 Å)
主引用文献	Structure-Activity Relationship Studies of 3- or 4-Pyridine Derivatives of DS-6930. Acs Med.Chem.Lett., 10, 2019

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BU of 3apq by Molmil

Crystal structure of J-Trx1 fragment of ERdj5
分子名称:	DnaJ homolog subfamily C member 10
著者	Inaba, K, Suzuki, M, Nagata, K.
登録日	2010-10-20
公開日	2011-04-20
最終更新日	2011-07-13
実験手法	X-RAY DIFFRACTION (1.84 Å)
主引用文献	Structural basis of an ERAD pathway mediated by the ER-resident protein disulfide reductase ERdj5. Mol.Cell, 41, 2011

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BU of 3apo by Molmil

Crystal structure of full-length ERdj5
分子名称:	DnaJ homolog subfamily C member 10
著者	Inaba, K, Suzuki, M, Nagata, K.
登録日	2010-10-20
公開日	2011-04-20
最終更新日	2011-07-13
実験手法	X-RAY DIFFRACTION (2.4 Å)
主引用文献	Structural basis of an ERAD pathway mediated by the ER-resident protein disulfide reductase ERdj5. Mol.Cell, 41, 2011

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BU of 3aps by Molmil

Crystal structure of Trx4 domain of ERdj5
分子名称:	DnaJ homolog subfamily C member 10, GLYCEROL, SULFATE ION
著者	Inaba, K, Suzuki, M, Nagata, K.
登録日	2010-10-20
公開日	2011-04-20
最終更新日	2011-07-13
実験手法	X-RAY DIFFRACTION (1.9 Å)
主引用文献	Structural basis of an ERAD pathway mediated by the ER-resident protein disulfide reductase ERdj5. Mol.Cell, 41, 2011

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BU of 3v9y by Molmil

Crystal structure of the PPARgamma-LBD complexed with a cercosporamide derivative modulator
分子名称:	4-{4-[({[(9aS)-8-acetyl-1,7-dihydroxy-3-methoxy-9a-methyl-9-oxo-9,9a-dihydrodibenzo[b,d]furan-4-yl]carbonyl}amino)methyl]naphthalen-2-yl}butanoic acid, Peptide from Nuclear receptor coactivator 1, Peroxisome proliferator-activated receptor gamma
著者	Matsui, Y, Hanzawa, H.
登録日	2011-12-28
公開日	2012-02-01
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (2.1 Å)
主引用文献	Substituents at the naphthalene C3 position of (-)-Cercosporamide derivatives significantly affect the maximal efficacy as PPAR(gamma) partial agonists Bioorg.Med.Chem.Lett., 22, 2012

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BU of 3v9v by Molmil

Crystal structure of the PPARgamma-LBD complexed with a cercosporamide derivative modulator
分子名称:	Peptide from Peroxisome proliferator-activated receptor gamma coactivator 1-alpha, Peroxisome proliferator-activated receptor gamma, methyl 3-{4-[({[(9aS)-8-acetyl-1,7-dihydroxy-3-methoxy-9a-methyl-9-oxo-9,9a-dihydrodibenzo[b,d]furan-4-yl]carbonyl}amino)methyl]naphthalen-2-yl}propanoate
著者	Matsui, Y, Hanzawa, H.
登録日	2011-12-28
公開日	2012-02-01
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (1.6 Å)
主引用文献	Substituents at the naphthalene C3 position of (-)-Cercosporamide derivatives significantly affect the maximal efficacy as PPAR(gamma) partial agonists Bioorg.Med.Chem.Lett., 22, 2011

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BU of 3v9t by Molmil

Crystal structure of the PPARgamma-LBD complexed with a cercosporamide derivative modulator
分子名称:	(9aS)-8-acetyl-N-[(3-ethoxynaphthalen-1-yl)methyl]-1,7-dihydroxy-3-methoxy-9a-methyl-9-oxo-9,9a-dihydrodibenzo[b,d]furan-4-carboxamide, Peptide from Peroxisome proliferator-activated receptor gamma coactivator 1-alpha, Peroxisome proliferator-activated receptor gamma
著者	Matsui, Y, Hanzawa, H.
登録日	2011-12-28
公開日	2012-02-01
最終更新日	2023-11-08
実験手法	X-RAY DIFFRACTION (1.65 Å)
主引用文献	Substituents at the naphthalene C3 position of (-)-Cercosporamide derivatives significantly affect the maximal efficacy as PPAR(gamma) partial agonists Bioorg.Med.Chem.Lett., 22, 2012

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BU of 3b1m by Molmil

Crystal structure of the PPARgamma-LBD complexed with a cercosporamide derivative modulator Cerco-A
分子名称:	(9aS)-8-acetyl-N-[(2-ethylnaphthalen-1-yl)methyl]-1,7-dihydroxy-3-methoxy-9a-methyl-9-oxo-9,9a-dihydrodibenzo[b,d]furan-4-carboxamide, Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor gamma coactivator 1-alpha
著者	Matsui, Y, Hiroyuki, H.
登録日	2011-07-05
公開日	2011-08-24
最終更新日	2023-11-01
実験手法	X-RAY DIFFRACTION (1.6 Å)
主引用文献	Pharmacology and in Vitro Profiling of a Novel Peroxisome Proliferator-Activated Receptor gamma Ligand, Cerco-A Biol.Pharm.Bull., 34, 2011

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