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8F1Y
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BU of 8f1y by Molmil
EGFR kinase in complex with poziotinib
分子名称: 1-[4-[4-[[3,4-bis(chloranyl)-2-fluoranyl-phenyl]amino]-7-methoxy-quinazolin-6-yl]oxypiperidin-1-yl]propan-1-one, CITRIC ACID, Epidermal growth factor receptor
著者Beyett, T.S, Eck, M.J.
登録日2022-11-06
公開日2023-11-08
実験手法X-RAY DIFFRACTION (2.75 Å)
主引用文献EGFR kinase in complex with poziotinib
To be published
8F1H
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BU of 8f1h by Molmil
EGFR kinase in complex with TAS6417 (CLN-081)
分子名称: CITRIC ACID, Epidermal growth factor receptor, N-[(5P,8S,10R)-4-amino-6-methyl-5-(quinolin-3-yl)-8,9-dihydropyrimido[5,4-b]indolizin-8-yl]prop-2-enamide
著者Beyett, T.S, Eck, M.J.
登録日2022-11-05
公開日2023-11-08
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献EGFR kinase in complex with TAS6417 (CLN-081)
To be published
8F1X
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BU of 8f1x by Molmil
EGFR kinase in complex with mobocertinib (TAK-788)
分子名称: Epidermal growth factor receptor, propan-2-yl 2-[[4-[2-(dimethylamino)ethyl-methyl-amino]-2-methoxy-5-(propanoylamino)phenyl]amino]-4-(1-methylindol-3-yl)pyrimidine-5-carboxylate
著者Beyett, T.S, Eck, M.J.
登録日2022-11-06
公開日2023-11-08
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献EGFR kinase in complex with mobocertinib (TAK-788)
To be published
8F1W
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BU of 8f1w by Molmil
EGFR(T790M/V948R) kinase in complex with poziotinib
分子名称: 1-[4-[4-[[3,4-bis(chloranyl)-2-fluoranyl-phenyl]amino]-7-methoxy-quinazolin-6-yl]oxypiperidin-1-yl]propan-1-one, Epidermal growth factor receptor
著者Beyett, T.S, Eck, M.J.
登録日2022-11-06
公開日2023-11-08
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献EGFR(T790M/V948R) kinase in complex with poziotinib
To be published
8GK5
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EGFR(T790M/V948R) kinase in complex with osimertinib and benzimidazole allosteric inhibitor
分子名称: 2-[(R)-(1H-benzimidazol-2-yl)(3-fluorophenyl)methyl]-6-[4-(1-methylpiperidin-4-yl)phenyl]-2,3-dihydro-1H-isoindol-1-one, Epidermal growth factor receptor, ~{N}-[2-[2-(dimethylamino)ethyl-methyl-amino]-4-methoxy-5-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]phenyl]propanamide
著者Beyett, T.S, Eck, M.J.
登録日2023-03-17
公開日2024-06-26
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Development of benzimidazole allosteric EGFR kinase inhibitors
To be published
8GB4
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BU of 8gb4 by Molmil
EGFR(T790M/V948R) kinase in complex with benzimidazole allosteric inhibitor
分子名称: 2-[(R)-(1H-benzimidazol-2-yl)(3-fluorophenyl)methyl]-6-[4-(1-methylpiperidin-4-yl)phenyl]-2,3-dihydro-1H-isoindol-1-one, Epidermal growth factor receptor, MAGNESIUM ION, ...
著者Beyett, T.S, Eck, M.J.
登録日2023-02-24
公開日2024-03-13
実験手法X-RAY DIFFRACTION (2.59 Å)
主引用文献EGFR(T790M/V948R) kinase in complex with benzimidazole allosteric inhibitor
To be published
1UX4
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BU of 1ux4 by Molmil
Crystal structures of a Formin Homology-2 domain reveal a tethered-dimer architecture
分子名称: BNI1 PROTEIN
著者Xu, Y, Moseley, J.B, Sagot, I, Poy, F, Pellman, D, Goode, B.L, Eck, M.J.
登録日2004-02-19
公開日2004-03-11
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献Crystal Structures of a Formin Homology-2 Domain Reveal a Tethered Dimer Architecture
Cell(Cambridge,Mass.), 116, 2004
1UX5
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Crystal Structures of a Formin Homology-2 domain reveal a flexibly tethered dimer architecture
分子名称: BNI1 PROTEIN
著者Xu, Y, Moseley, J.B, Sagot, I, Poy, F, Pellman, D, Goode, B.L, Eck, M.J.
登録日2004-02-19
公開日2004-03-11
最終更新日2019-05-08
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal Structures of a Formin Homology-2 Domain Reveal a Tethered Dimer Architecture
Cell(Cambridge,Mass.), 116, 2004
4Z32
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BU of 4z32 by Molmil
Crystal Structure of the FERM-SH2 Domains of Jak2
分子名称: Tyrosine-protein kinase JAK2
著者McNally, R, Eck, M.J.
登録日2015-03-30
公開日2016-06-22
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (3.04 Å)
主引用文献Crystal Structure of the FERM-SH2 Module of Human Jak2.
Plos One, 11, 2016
1I3Z
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BU of 1i3z by Molmil
MURINE EAT2 SH2 DOMAIN IN COMPLEX WITH SLAM PHOSPHOPEPTIDE
分子名称: EWS/FLI1 ACTIVATED TRANSCRIPT 2, SIGNALING LYMPHOCYTIC ACTIVATION MOLECULE
著者Lu, J, Poy, F, Morra, M, Terhorst, C, Eck, M.J.
登録日2001-02-19
公開日2003-04-08
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Structural basis for the interaction of the free SH2 domain EAT-2 with SLAM receptors in hematopoietic cells.
Eur.J.Biochem., 20, 2001
3IKA
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BU of 3ika by Molmil
Crystal Structure of EGFR 696-1022 T790M Mutant Covalently Binding to WZ4002
分子名称: Epidermal growth factor receptor, N-{3-[(5-chloro-2-{[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-4-yl)oxy]phenyl}prop-2-enamide
著者Yun, C.-H, Eck, M.J.
登録日2009-08-05
公開日2010-01-12
最終更新日2021-10-13
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Novel mutant-selective EGFR kinase inhibitors against EGFR T790M.
Nature, 462, 2009
4R3R
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BU of 4r3r by Molmil
Crystal structures of EGFR in complex with Mig6
分子名称: Epidermal growth factor receptor, peptide from ERBB receptor feedback inhibitor 1'
著者Park, E, Kim, N, Yi, Z, Cho, A, Kim, K, Ficarro, S.B, Park, A, Park, W.Y, Murray, B, Meyerson, M, Beroukim, R, Marto, J.A, Cho, J, Eck, M.J.
登録日2014-08-17
公開日2015-08-12
最終更新日2015-09-16
実験手法X-RAY DIFFRACTION (3.25 Å)
主引用文献Structure and mechanism of activity-based inhibition of the EGF receptor by Mig6.
Nat.Struct.Mol.Biol., 22, 2015
8FV4
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BU of 8fv4 by Molmil
EGFR(T790M/V948R) in complex with compound 2 (LN5993)
分子名称: Epidermal growth factor receptor, MAGNESIUM ION, N-{(3P)-3-[(4P)-4-(2-acetamidopyridin-4-yl)-2-(methylsulfanyl)-1H-imidazol-5-yl]phenyl}-11-oxo-10,11-dihydro-5H-dibenzo[b,e][1,4]diazepine-9-carboxamide, ...
著者Ogboo, B.C, Beyett, T.S, Eck, M.J, Heppner, D.E.
登録日2023-01-18
公開日2024-01-17
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Linking ATP and allosteric sites to achieve superadditive binding with bivalent EGFR kinase inhibitors.
Commun Chem, 7, 2024
2SHP
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BU of 2shp by Molmil
TYROSINE PHOSPHATASE SHP-2
分子名称: DODECANE-TRIMETHYLAMINE, SHP-2
著者Hof, P, Pluskey, S, Dhe-Paganon, S, Eck, M.J, Shoelson, S.E.
登録日1997-12-01
公開日1999-02-16
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal structure of the tyrosine phosphatase SHP-2.
Cell(Cambridge,Mass.), 92, 1998
8DSW
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BU of 8dsw by Molmil
Crystal structure of EGFR kinase domain, Exon20 Insertion FQEA mutant
分子名称: Epidermal growth factor receptor, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ...
著者Park, E, Eck, M.J.
登録日2022-07-23
公開日2023-09-27
実験手法X-RAY DIFFRACTION (2.39 Å)
主引用文献Structural basis for oncogenic activation of the epidermal growth factor receptor by the InsFQEA exon 20 insertion
To Be Published
2SRC
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BU of 2src by Molmil
CRYSTAL STRUCTURE OF HUMAN TYROSINE-PROTEIN KINASE C-SRC, IN COMPLEX WITH AMP-PNP
分子名称: PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, TYROSINE-PROTEIN KINASE SRC
著者Xu, W, Doshi, A, Lei, M, Eck, M.J, Harrison, S.C.
登録日1998-12-29
公開日1999-07-22
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Crystal structures of c-Src reveal features of its autoinhibitory mechanism.
Mol.Cell, 3, 1999
2AEH
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BU of 2aeh by Molmil
Focal adhesion kinase 1
分子名称: Focal adhesion kinase 1
著者Ceccarelli, D.F, Song, H.K, Poy, F, Schaller, M.D, Eck, M.J.
登録日2005-07-22
公開日2005-10-18
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.53 Å)
主引用文献Crystal Structure of the FERM Domain of Focal Adhesion Kinase
J.Biol.Chem., 281, 2006
8F7O
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BU of 8f7o by Molmil
BRAF kinase in complex with TAK580 (tovorafenib)
分子名称: 6-amino-5-chloro-N-[(1R)-1-(5-{[5-chloro-4-(trifluoromethyl)pyridin-2-yl]carbamoyl}-1,3-thiazol-2-yl)ethyl]pyrimidine-4-carboxamide, Serine/threonine-protein kinase B-raf
著者Tkacik, E, Li, K, Gonzalez Del-Pino, G, Eck, M.J.
登録日2022-11-20
公開日2023-04-12
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (3.54 Å)
主引用文献Structure and RAF family kinase isoform selectivity of type II RAF inhibitors tovorafenib and naporafenib.
J.Biol.Chem., 299, 2023
8F7P
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BRAF kinase in complex with LXH254 (naporafenib)
分子名称: N-{3-[2-(2-hydroxyethoxy)-6-(morpholin-4-yl)pyridin-4-yl]-4-methylphenyl}-2-(trifluoromethyl)pyridine-4-carboxamide, Serine/threonine-protein kinase B-raf
著者Tkacik, E, Li, K, Gonzalez Del-Pino, G, Eck, M.J.
登録日2022-11-20
公開日2023-04-12
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.74 Å)
主引用文献Structure and RAF family kinase isoform selectivity of type II RAF inhibitors tovorafenib and naporafenib.
J.Biol.Chem., 299, 2023
2AL6
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BU of 2al6 by Molmil
FERM domain of Focal Adhesion Kinase
分子名称: Focal adhesion kinase 1
著者Ceccarelli, D.F, Song, H.K, Poy, F, Schaller, M.D, Eck, M.J.
登録日2005-08-04
公開日2005-10-18
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Crystal Structure of the FERM Domain of Focal Adhesion Kinase
J.Biol.Chem., 281, 2006
8EME
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BU of 8eme by Molmil
EGFR(T790M/V948R) in complex with ZNL-0056
分子名称: Epidermal growth factor receptor, N-{7-methyl-1-[(3S)-1-(prop-2-enoyl)azepan-3-yl]-1H-benzimidazol-2-yl}-5-(prop-2-enamido)thiophene-3-carboxamide
著者Beyett, T.S, Eck, M.J.
登録日2022-09-27
公開日2023-10-18
最終更新日2024-07-10
実験手法X-RAY DIFFRACTION (3.32 Å)
主引用文献Molecular Bidents with Two Electrophilic Warheads as a New Pharmacological Modality.
Acs Cent.Sci., 10, 2024
1YVJ
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BU of 1yvj by Molmil
Crystal structure of the Jak3 kinase domain in complex with a staurosporine analogue
分子名称: (2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-DIOL, 1,2,3,4-TETRAHYDROGEN-STAUROSPORINE, Tyrosine-protein kinase JAK3
著者Boggon, T.J, Li, Y, Manley, P.W, Eck, M.J.
登録日2005-02-15
公開日2005-05-24
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Crystal structure of the Jak3 kinase domain in complex with a staurosporine analog
Blood, 106, 2005
2CBL
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BU of 2cbl by Molmil
N-TERMINAL DOMAIN OF CBL IN COMPLEX WITH ITS BINDING SITE ON ZAP-70
分子名称: CALCIUM ION, PROTO-ONCOGENE CBL, ZAP-70
著者Meng, W, Sawasdikosol, S, Burakoff, S.J, Eck, M.J.
登録日1998-08-28
公開日1999-05-18
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structure of the amino-terminal domain of Cbl complexed to its binding site on ZAP-70 kinase.
Nature, 398, 1999
7U98
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EGFR(T790M/V948R) in complex with a macrocyclic inhibitor
分子名称: 19-chloro-18-fluoro-22-methoxy-8,9,11,12,14,15-hexahydro-21H-4,6-ethenopyrimido[5,4-m][1,4,7,10,15]benzotetraoxazacycloheptadecine, Epidermal growth factor receptor
著者Beyett, T.S, Eck, M.J.
登録日2022-03-10
公開日2022-11-23
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (3.42 Å)
主引用文献Macrocyclization of Quinazoline-Based EGFR Inhibitors Leads to Exclusive Mutant Selectivity for EGFR L858R and Del19.
J.Med.Chem., 65, 2022
7U99
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EGFR kinase in complex with a macrocyclic inhibitor
分子名称: 19-chloro-22-methoxy-8,9,11,12,14,15-hexahydro-21H-4,6-ethenopyrimido[5,4-m][1,4,7,10,15]benzotetraoxazacycloheptadecine, CITRATE ANION, Epidermal growth factor receptor
著者Beyett, T.S, Eck, M.J.
登録日2022-03-10
公開日2022-11-23
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Macrocyclization of Quinazoline-Based EGFR Inhibitors Leads to Exclusive Mutant Selectivity for EGFR L858R and Del19.
J.Med.Chem., 65, 2022

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件を2024-08-28に公開中

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