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PDB: 51 件

8P72
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BU of 8p72 by Molmil
Cryo-EM structure of CAK in complex with inhibitor ICEC0768
分子名称: CDK-activating kinase assembly factor MAT1, Cyclin-H, Cyclin-dependent kinase 7, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (1.9 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8PLZ
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Cryo-EM structure of CAK in complex with inhibitor CT7030
分子名称: (3~{R},4~{R})-4-[[[7-[(2-methoxyphenyl)methylamino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]piperidin-3-ol, CDK-activating kinase assembly factor MAT1, Cyclin-H, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-06-27
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (1.9 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P6W
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Cryo-EM structure of CAK in complex with inhibitor BS-181
分子名称: CDK-activating kinase assembly factor MAT1, Cyclin-H, Cyclin-dependent kinase 7, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (1.9 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P70
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Cryo-EM structure of CAK in complex with inhibitor ICEC0510-S
分子名称: CDK-activating kinase assembly factor MAT1, Cyclin-H, Cyclin-dependent kinase 7, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P6Z
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BU of 8p6z by Molmil
Cryo-EM structure of CAK in complex with inhibitor ICEC0510-R
分子名称: CDK-activating kinase assembly factor MAT1, Cyclin-H, Cyclin-dependent kinase 7, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2.1 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P73
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Cryo-EM structure of CAK in complex with inhibitor ICEC0829
分子名称: (3R,4R)-4-[[[7-[(phenylmethyl)amino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]piperidine-3,4-diol, (3S,4S)-4-[[[7-[(phenylmethyl)amino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]piperidine-3,4-diol, CDK-activating kinase assembly factor MAT1, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P6X
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BU of 8p6x by Molmil
Cryo-EM structure of CAK in complex with inhibitor BS-194
分子名称: (2S,3S)-3-{[7-(benzylamino)-3-(1-methylethyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino}butane-1,2,4-triol, CDK-activating kinase assembly factor MAT1, Cyclin-H, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (1.9 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P74
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BU of 8p74 by Molmil
Cryo-EM structure of CAK in complex with inhibitor ICEC0880 (ring-up conformation)
分子名称: (2S,3S)-3-[[7-[(2-bromophenyl)methylamino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]butane-1,2,4-triol, CDK-activating kinase assembly factor MAT1, Cyclin-H, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2.2 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P7L
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BU of 8p7l by Molmil
Cryo-EM structure of CDK7 subunit of CAK in complex with inhibitor LDC4297
分子名称: 2-[(3S)-piperidin-3-yl]oxy-8-propan-2-yl-N-[(2-pyrazol-1-ylphenyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-4-amine, CDK-activating kinase assembly factor MAT1, Cyclin-dependent kinase 7
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2.1 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P75
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BU of 8p75 by Molmil
Cryo-EM structure of CAK in complex with inhibitor ICEC0880 (ring-down conformation)
分子名称: (2S,3S)-3-[[7-[(2-bromophenyl)methylamino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]butane-1,2,4-triol, CDK-activating kinase assembly factor MAT1, Cyclin-H, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P71
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BU of 8p71 by Molmil
Cryo-EM structure of CAK in complex with inhibitor ICEC0574
分子名称: (3R,4S)-4-[[7-[(phenylmethyl)amino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]pyrrolidin-3-ol, CDK-activating kinase assembly factor MAT1, Cyclin-H, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P77
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BU of 8p77 by Molmil
Cryo-EM structure of CAK in complex with inhibitor ICEC0943
分子名称: (3S,4S)-4-[[[7-[(phenylmethyl)amino]-3-propan-2-yl-pyrazolo[1,5-a]pyrimidin-5-yl]amino]methyl]piperidin-3-ol, CDK-activating kinase assembly factor MAT1, Cyclin-H, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (1.8 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P76
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BU of 8p76 by Molmil
Cryo-EM structure of CAK in complex with inhibitor ICEC0914
分子名称: CDK-activating kinase assembly factor MAT1, Cyclin-H, Cyclin-dependent kinase 7, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (2 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P78
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BU of 8p78 by Molmil
Cryo-EM structure of CAK in complex with inhibitor dinaciclib
分子名称: 3-[({3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl}amino)methyl]-1-hydroxypyridinium, CDK-activating kinase assembly factor MAT1, Cyclin-H, ...
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (1.9 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
8P79
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BU of 8p79 by Molmil
Cryo-EM structure of CAK with averaged inhibitor density
分子名称: CDK-activating kinase assembly factor MAT1, Cyclin-H, Cyclin-dependent kinase 7
著者Cushing, V.I, Koh, A.F, Feng, J, Jurgaityte, K, Bahl, A.K, Ali, S, Kotecha, A, Greber, B.J.
登録日2023-05-30
公開日2024-03-20
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (1.7 Å)
主引用文献High-resolution cryo-EM of the human CDK-activating kinase for structure-based drug design.
Nat Commun, 15, 2024
3S1I
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BU of 3s1i by Molmil
Crystal structure of oxygen-bound hell's gate globin I
分子名称: Hemoglobin-like flavoprotein, OXYGEN MOLECULE, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Teh, A.H, Saito, J.A, Baharuddin, A, Tuckerman, J.R, Newhouse, J.S, Kanbe, M, Newhouse, E.I, Rahim, R.A, Favier, F, Didierjean, C, Sousa, E.H.S, Stott, M.B, Dunfield, P.F, Gonzalez, G, Gilles-Gonzalez, M.A, Najimudin, N, Alam, M.
登録日2011-05-15
公開日2011-09-21
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.77 Å)
主引用文献Hell's Gate globin I: an acid and thermostable bacterial hemoglobin resembling mammalian neuroglobin
Febs Lett., 585, 2011
3S1J
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BU of 3s1j by Molmil
Crystal structure of acetate-bound hell's gate globin I
分子名称: ACETATE ION, Hemoglobin-like flavoprotein, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Teh, A.H, Saito, J.A, Baharuddin, A, Tuckerman, J.R, Newhouse, J.S, Kanbe, M, Newhouse, E.I, Rahim, R.A, Favier, F, Didierjean, C, Sousa, E.H.S, Stott, M.B, Dunfield, P.F, Gonzalez, G, Gilles-Gonzalez, M.A, Najimudin, N, Alam, M.
登録日2011-05-15
公開日2011-09-21
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Hell's Gate globin I: an acid and thermostable bacterial hemoglobin resembling mammalian neuroglobin
Febs Lett., 585, 2011
3SO3
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BU of 3so3 by Molmil
Structures of Fab-Protease Complexes Reveal a Highly Specific Non-Canonical Mechanism of Inhibition.
分子名称: A11 FAB heavy chain, A11 FAB light chain, GLYCEROL, ...
著者Schneider, E.L, Farady, C.J, Egea, P.F, Goetz, D.H, Baharuddin, A, Craik, C.S.
登録日2011-06-29
公開日2012-06-20
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献A reverse binding motif that contributes to specific protease inhibition by antibodies.
J.Mol.Biol., 415, 2012
1GMM
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BU of 1gmm by Molmil
Carbohydrate binding module CBM6 from xylanase U Clostridium thermocellum
分子名称: CALCIUM ION, CBM6, SODIUM ION, ...
著者Czjzek, M, Mosbah, A, Bolam, D, Allouch, J, Zamboni, V, Henrissat, B, Gilbert, H.J.
登録日2001-09-19
公開日2001-11-28
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The Location of the Ligand-Binding Site of Carbohydrate-Binding Modules that Have Evolved from a Common Sequence is not Conserved.
J.Biol.Chem., 276, 2001
1XO3
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BU of 1xo3 by Molmil
Solution Structure of Ubiquitin like protein from Mus Musculus
分子名称: RIKEN cDNA 2900073H19
著者Singh, S, Tonelli, M, Tyler, R.C, Bahrami, A, Lee, M.S, Markley, J.L, Center for Eukaryotic Structural Genomics (CESG)
登録日2004-10-05
公開日2004-10-19
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Three-dimensional structure of the AAH26994.1 protein from Mus musculus, a putative eukaryotic Urm1.
Protein Sci., 14, 2005
2DRK
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BU of 2drk by Molmil
Acanthamoeba myosin I SH3 domain bound to Acan125
分子名称: 10-mer peptide from Myosin-I binding protein Acan125, GLYCEROL, Myosin heavy chain IB, ...
著者Houdusse, A, Bahloul, A, Ostap, E.M.
登録日2006-06-09
公開日2007-05-29
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献The crystal structure of the SH3 domain of Acanthamoeba myosin IB bound to Acan125
To be Published
1I26
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BU of 1i26 by Molmil
SOLUTION STRUCTURE OF PTU-1, A TOXIN FROM THE ASSASSIN BUGS PEIRATES TURPIS THAT BLOCKS THE VOLTAGE SENSITIVE CALCIUM CHANNEL N-TYPE
分子名称: PTU-1
著者Bernard, C, Corzo, G, Mosbah, A, Nakajima, T, Darbon, H.
登録日2001-02-06
公開日2001-11-21
最終更新日2022-02-23
実験手法SOLUTION NMR
主引用文献Solution structure of Ptu1, a toxin from the assassin bug Peirates turpis that blocks the voltage-sensitive calcium channel N-type.
Biochemistry, 40, 2001
2BKI
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BU of 2bki by Molmil
Myosin VI nucleotide-free (MDinsert2-IQ) crystal structure
分子名称: CALCIUM ION, CALMODULIN, SULFATE ION, ...
著者Menetrey, J, Bahloul, A, Yengo, C, Wells, A, Morris, C, Sweeney, H.L, Houdusse, A.
登録日2005-02-16
公開日2005-06-07
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献The Structure of the Myosin Vi Motor Reveals the Mechanism of Directionality Reversal
Nature, 435, 2005
2BKH
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BU of 2bkh by Molmil
Myosin VI nucleotide-free (MDInsert2) crystal structure
分子名称: CALCIUM ION, CALMODULIN, GLYCEROL, ...
著者Menetrey, J, Bahloul, A, Yengo, C, Wells, A, Morris, C, Sweeney, H.L, Houdusse, A.
登録日2005-02-16
公開日2005-06-07
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献The Structure of the Myosin Vi Motor Reveals the Mechanism of Directionality Reversal
Nature, 435, 2005
2DRM
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BU of 2drm by Molmil
Acanthamoeba myosin I SH3 domain bound to Acan125
分子名称: 18-mer peptide from Acan125, Acanthamoeba Myosin IB, GLYCEROL, ...
著者Houdusse, A, Bahloul, A, Ostap, E.M.
登録日2006-06-09
公開日2007-05-29
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献The crystal structure of the SH3 domain of Acanthamoeba myosin IB bound to Acan125
To be Published

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