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PDB: 27 件

4U77
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BTB domain from Drosophila CP190
分子名称: Centrosome-associated zinc finger protein CP190, DIMETHYL SULFOXIDE, GLYCEROL
著者Allemand, F, Cohen-Gonsaud, M, Labesse, G, Nollmann, M.
登録日2014-07-30
公開日2014-08-13
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.03 Å)
主引用文献Chromatin Insulator Factors Involved in Long-Range DNA Interactions and Their Role in the Folding of the Drosophila Genome.
Plos Genet., 10, 2014
8P29
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BU of 8p29 by Molmil
TEAD2 in complex with an inhibitor
分子名称: 5-methyl-2-[(3-phenylmethoxyphenyl)amino]benzoic acid, GLYCEROL, MYRISTIC ACID, ...
著者Guichou, J.F, Gelin, M, Allemand, F.
登録日2023-05-15
公開日2023-11-22
実験手法X-RAY DIFFRACTION (2.06 Å)
主引用文献Development of LM-41 and AF-2112, two flufenamic acid-derived TEAD inhibitors obtained through the replacement of the trifluoromethyl group by aryl rings.
Bioorg.Med.Chem.Lett., 95, 2023
7OYJ
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BU of 7oyj by Molmil
Crystal structure of hTEAD2 in complex with fragment at the interface 2
分子名称: 3-(1~{H}-pyrazol-5-yl)aniline, PALMITIC ACID, Transcriptional enhancer factor TEF-4
著者Guichou, J.F, Gelin, M, Allemand, F.
登録日2021-06-24
公開日2022-05-25
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.91 Å)
主引用文献Toward the Design of Ligands Selective for the C-Terminal Domain of TEADs.
J.Med.Chem., 65, 2022
6EWX
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BU of 6ewx by Molmil
Structure of Pragmin pseudo-kinase reveals a dimerization mechanism to regulate protein tyrosine phosphorylation and nuclear transcription
分子名称: PEAK1-related kinase-activating pseudokinase 1, SULFATE ION
著者Gelin, M, Allemand, F, Fournet, A, Labesse, G.
登録日2017-11-06
公開日2018-01-31
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.771 Å)
主引用文献Dimerization of the Pragmin Pseudo-Kinase Regulates Protein Tyrosine Phosphorylation.
Structure, 26, 2018
4QT2
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BU of 4qt2 by Molmil
Crystal Structure of the FK506-Binding Domain of Plasmodium Falciparum FKBP35 in complex with Rapamycin
分子名称: FK506-binding protein (FKBP)-type peptidyl-propyl isomerase, IMIDAZOLE, RAPAMYCIN IMMUNOSUPPRESSANT DRUG
著者Bianchin, A, Allemand, F, Bell, A, Chubb, A.J, Guichou, J.-F.
登録日2014-07-07
公開日2015-06-10
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.44 Å)
主引用文献Two crystal structures of the FK506-binding domain of Plasmodium falciparum FKBP35 in complex with rapamycin at high resolution
Acta Crystallogr.,Sect.D, 71, 2015
2RVJ
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BU of 2rvj by Molmil
NMR structure of Epithelial splicing regulatory protein 1
分子名称: Epithelial splicing regulatory protein 1
著者Yang, Y, Allemand, F, Guichou, J, Labesse, G.
登録日2015-10-23
公開日2015-12-23
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献NMR structure of Epithelial splicing regulatory protein 1
To be Published
2GHJ
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BU of 2ghj by Molmil
Crystal structure of folded and partially unfolded forms of Aquifex aeolicus ribosomal protein L20
分子名称: 50S ribosomal protein L20, SULFATE ION
著者Timsit, Y, Allemand, F, Chiaruttini, C, Springer, M.
登録日2006-03-27
公開日2006-04-18
最終更新日2018-02-07
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Coexistence of two protein folding states in the crystal structure of ribosomal protein L20
Embo Rep., 7, 2006
4QT3
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Crystal structure resolution of Plasmodium falciparum FK506 binding domain (FKBP35) in complex with Rapamycin at 1.4A resolution
分子名称: (2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, FK506-binding protein (FKBP)-type peptidyl-propyl isomerase, RAPAMYCIN IMMUNOSUPPRESSANT DRUG
著者Bianchin, A, Allemand, F, Bell, A, Chubb, A.J, Guichou, J.-F.
登録日2014-07-07
公開日2015-06-10
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Two crystal structures of the FK506-binding domain of Plasmodium falciparum FKBP35 in complex with rapamycin at high resolution
Acta Crystallogr.,Sect.D, 71, 2015
8PUY
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BU of 8puy by Molmil
TEAD2 with a covalent inhibitor
分子名称: MYRISTIC ACID, Transcriptional enhancer factor TEF-4, ~{N}-[3-[(3-pentoxyphenyl)amino]phenyl]propanamide
著者Guichou, J.F, Gelin, M, Allemand, F.
登録日2023-07-17
公開日2023-12-13
最終更新日2024-01-03
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Development of HC-258, a Covalent Acrylamide TEAD Inhibitor That Reduces Gene Expression and Cell Migration.
Acs Med.Chem.Lett., 14, 2023
8PUX
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BU of 8pux by Molmil
TEAD2 with a covalent inhibitor
分子名称: MYRISTIC ACID, Transcriptional enhancer factor TEF-4, ~{N}-[2-[(3-pentoxyphenyl)amino]phenyl]propanamide
著者Guichou, J.F, Gelin, M, Allemand, F.
登録日2023-07-17
公開日2023-12-13
最終更新日2024-01-03
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Development of HC-258, a Covalent Acrylamide TEAD Inhibitor That Reduces Gene Expression and Cell Migration.
Acs Med.Chem.Lett., 14, 2023
6S66
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Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: 1-(2-azanylethyl)-3-(3,4-dichlorophenyl)-~{N}-(phenylmethyl)pyrazole-4-carboxamide, MYRISTIC ACID, Transcriptional enhancer factor TEF-4
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-02
公開日2020-07-22
最終更新日2022-02-02
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
6S69
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BU of 6s69 by Molmil
Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: 3-[3-(3,4-dichlorophenyl)-4-(2-phenylethylcarbamoyl)pyrazol-1-yl]propanoic acid, MYRISTIC ACID, Transcriptional enhancer factor TEF-4
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-02
公開日2020-07-22
最終更新日2022-02-02
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
6S60
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Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: 4-[3-(3,4-dichlorophenyl)-4-[(phenylmethyl)carbamoyl]pyrazol-1-yl]butanoic acid, MYRISTIC ACID, Transcriptional enhancer factor TEF-4
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-02
公開日2020-07-22
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
6S64
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BU of 6s64 by Molmil
Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: 3-[3-(3,4-dichlorophenyl)-4-[(phenylmethyl)carbamoyl]pyrazol-1-yl]propanoic acid, MYRISTIC ACID, PALMITIC ACID, ...
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-02
公開日2020-07-22
最終更新日2022-02-02
実験手法X-RAY DIFFRACTION (2.22 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
6S6J
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BU of 6s6j by Molmil
Crystal structure of hTEAD2 in complex with a trisubstituted pyrazole inhibitor
分子名称: MYRISTIC ACID, Transcriptional enhancer factor TEF-4, ethyl 1-(4-azanylbutyl)-3-(3,4-dichlorophenyl)pyrazole-4-carboxylate
著者Sturbaut, M, Allemand, F, Guichou, J.F.
登録日2019-07-03
公開日2020-07-22
最終更新日2022-02-02
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors.
Eur.J.Med.Chem., 226, 2021
4ZSC
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BU of 4zsc by Molmil
Human Cyclophilin D Complexed with an Inhibitor at room temperature
分子名称: Peptidyl-prolyl cis-trans isomerase F, mitochondrial, ethyl N-[(4-aminobenzyl)carbamoyl]glycinate
著者Gelin, M, Delfosse, V, Allemand, F, Hoh, F, Sallaz-Damaz, Y, Pirocchi, M, Bourguet, W, Ferrer, J.-L, Labesse, G, Guichou, J.-F.
登録日2015-05-13
公開日2015-08-12
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4ZSD
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BU of 4zsd by Molmil
Human Cyclophilin D Complexed with an Inhibitor at room temperature
分子名称: 1-(4-aminobenzyl)-3-[(2S)-4-(methylsulfanyl)-1-{(2R)-2-[2-(methylsulfanyl)phenyl]pyrrolidin-1-yl}-1-oxobutan-2-yl]urea, Peptidyl-prolyl cis-trans isomerase F, mitochondrial
著者Gelin, M, Delfosse, V, Allemand, F, Hoh, F, Sallaz-Damaz, Y, Pirocchi, M, Bourguet, W, Ferrer, J.-L, Labesse, G, Guichou, J.-F.
登録日2015-05-13
公開日2015-08-12
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4XNE
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BU of 4xne by Molmil
Crystal structure of ERK2 in complex with an inhibitor
分子名称: 1-phenyl-1H-1,2,4-triazole-3,5-diamine, Mitogen-activated protein kinase 1, SULFATE ION
著者Gelin, M, Allemand, F, Labesse, G, Guichou, J.F.
登録日2015-01-15
公開日2015-08-12
最終更新日2015-08-19
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4XP2
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BU of 4xp2 by Molmil
Crystal structure of ERK2 in complex with an inhibitor
分子名称: 1-phenyl-1H-1,2,4-triazole-3,5-diamine, DIMETHYL SULFOXIDE, Mitogen-activated protein kinase 1, ...
著者Gelin, M, Allemand, F, Labesse, G, Guichou, J.F.
登録日2015-01-16
公開日2015-08-12
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.748 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4XN6
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BU of 4xn6 by Molmil
Crystal structure at room temperature of hen-egg lysozyme in complex with benzamidine
分子名称: BENZAMIDINE, Lysozyme C
著者Gelin, M, Allemand, F, Labesse, G, Guichou, J.F.
登録日2015-01-15
公開日2015-08-12
最終更新日2021-08-04
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4XOZ
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BU of 4xoz by Molmil
Crystal structure of ERK2 in complex with an inhibitor
分子名称: Mitogen-activated protein kinase 1, N~1~-[3-(benzyloxy)benzyl]-1H-tetrazole-1,5-diamine, SULFATE ION
著者Gelin, M, Allemand, F, Labesse, G, Guichou, J.F.
登録日2015-01-16
公開日2015-08-12
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4XRL
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BU of 4xrl by Molmil
Crystal structure at room temperature of Erk2 in complex with an inhibitor
分子名称: 1H-pyrrolo[2,3-b]pyridine-3-carbonitrile, Mitogen-activated protein kinase 1, SULFATE ION
著者Gelin, M, Allemand, F, Labesse, G, Guichou, J.F.
登録日2015-01-21
公開日2016-03-23
最終更新日2016-03-30
実験手法X-RAY DIFFRACTION (2.554 Å)
主引用文献Combining 'dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4XNC
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BU of 4xnc by Molmil
Crystal structure at room temperature of cyclophilin D in complex with an inhibitor
分子名称: Peptidyl-prolyl cis-trans isomerase F, mitochondrial, ethyl N-[(4-aminobenzyl)carbamoyl]glycinate
著者Gelin, M, Allemand, F, Labesse, G, Guichou, J.F.
登録日2015-01-15
公開日2015-08-12
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.23 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4XOY
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BU of 4xoy by Molmil
Crystal structure of ERK2 in complex with an inhibitor
分子名称: 2-amino-1,9-dihydro-6H-purine-6-thione, Mitogen-activated protein kinase 1, SULFATE ION
著者Gelin, M, Allemand, F, Labesse, G, Guichou, J.F.
登録日2015-01-16
公開日2015-08-12
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015
4XP0
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BU of 4xp0 by Molmil
Crystal structure of ERK2 in complex with an inhibitor
分子名称: 1H-pyrrolo[2,3-b]pyridine-3-carbonitrile, DIMETHYL SULFOXIDE, Mitogen-activated protein kinase 1, ...
著者Gelin, M, Allemand, F, Labesse, G, Guichou, J.F.
登録日2015-01-16
公開日2015-08-12
最終更新日2017-09-06
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography.
Acta Crystallogr.,Sect.D, 71, 2015

 

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件を2024-08-07に公開中

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