PDB: 495 件ウェブページステータス検索Chemie searchBIRD

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7M0U	Crystal structure of the BRAF:MEK1 kinases in complex with AMPPNP and Binimetinib 分子名称: 5-[(4-bromo-2-fluorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide, Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ... 著者 Li, K, Gonzalez Del-Pino, G, Ha, B.H, Park, E, Eck, M.J. 登録日 2021-03-11 公開日 2021-04-21 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.09 Å) 主引用文献 Allosteric MEK inhibitors act on BRAF/MEK complexes to block MEK activation. Proc.Natl.Acad.Sci.USA, 118, 2021
7M0V	Crystal structure of the BRAF:MEK1 kinases in complex with AMPPNP and Cobimetinib 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ... 著者 Li, K, Gonzalez Del-Pino, G, Ha, B.H, Park, E, Eck, M.J. 登録日 2021-03-11 公開日 2021-04-21 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.16 Å) 主引用文献 Allosteric MEK inhibitors act on BRAF/MEK complexes to block MEK activation. Proc.Natl.Acad.Sci.USA, 118, 2021
7M0T	Crystal structure of the BRAF:MEK1 kinases in complex with AMPPNP and Selumetinib 分子名称: 5-[(4-bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide, Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ... 著者 Li, K, Gonzalez Del-Pino, G, Ha, B.H, Park, E, Eck, M.J. 登録日 2021-03-11 公開日 2021-04-21 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.19 Å) 主引用文献 Allosteric MEK inhibitors act on BRAF/MEK complexes to block MEK activation. Proc.Natl.Acad.Sci.USA, 118, 2021
7M0W	Crystal structure of the BRAF:MEK1 kinases in complex with AMPPNP and Pimasertib 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, N-[(2S)-2,3-dihydroxypropyl]-3-[(2-fluoro-4-iodophenyl)amino]pyridine-4-carboxamide, ... 著者 Li, K, Gonzalez Del-Pino, G, Ha, B.H, Park, E, Eck, M.J. 登録日 2021-03-11 公開日 2021-04-21 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.09 Å) 主引用文献 Allosteric MEK inhibitors act on BRAF/MEK complexes to block MEK activation. Proc.Natl.Acad.Sci.USA, 118, 2021
7NR9	Discovery of ASTX029, a clinical candidate which modulates the phosphorylation and catalytic activity of ERK1/2 分子名称: (2~{R})-2-[5-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]-~{N}-[(1~{S})-1-(2-methoxypyridin-4-yl)-2-oxidanyl-ethyl]propanamide, Mitogen-activated protein kinase 1, SULFATE ION 著者 O'Reilly, M, Cleasby, A. 登録日 2021-03-03 公開日 2021-10-06 実験手法 X-RAY DIFFRACTION (1.906 Å) 主引用文献 Discovery of ASTX029, A Clinical Candidate Which Modulates the Phosphorylation and Catalytic Activity of ERK1/2. J.Med.Chem., 64, 2021
7NR8	Discovery of ASTX029, a clinical candidate which modulates the phosphorylation and catalytic activity of ERK1/2 分子名称: (2~{R})-2-[5-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]-~{N}-[(1~{S})-1-[6-(4-methylpiperazin-1-yl)pyridin-2-yl]-2-oxidanyl-ethyl]propanamide, 1,2-ETHANEDIOL, DIMETHYL SULFOXIDE, ... 著者 O'Reilly, M, Cleasby, A. 登録日 2021-03-03 公開日 2021-10-06 実験手法 X-RAY DIFFRACTION (1.627 Å) 主引用文献 Discovery of ASTX029, A Clinical Candidate Which Modulates the Phosphorylation and Catalytic Activity of ERK1/2. J.Med.Chem., 64, 2021
7NR5	Discovery of ASTX029, a clinical candidate which modulates the phosphorylation and catalytic activity of ERK1/2 分子名称: (2~{R})-2-[5-[5-chloranyl-2-[(2-methyl-1,2,3-triazol-4-yl)amino]pyrimidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]-~{N}-[(1~{S})-1-(3-fluoranyl-5-methoxy-phenyl)-2-oxidanyl-ethyl]propanamide, Mitogen-activated protein kinase 1, SULFATE ION 著者 O'Reilly, M, Cleasby, A. 登録日 2021-03-03 公開日 2021-10-06 実験手法 X-RAY DIFFRACTION (1.766 Å) 主引用文献 Discovery of ASTX029, A Clinical Candidate Which Modulates the Phosphorylation and Catalytic Activity of ERK1/2. J.Med.Chem., 64, 2021
7NR3	Discovery of ASTX029, a clinical candidate which modulates the phosphorylation and catalytic activity of ERK1/2 分子名称: 6-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-2-[2-oxidanylidene-2-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]-3~{H}-isoindol-1-one, Mitogen-activated protein kinase 1, SULFATE ION 著者 O'Reilly, M. 登録日 2021-03-02 公開日 2021-10-06 実験手法 X-RAY DIFFRACTION (1.897 Å) 主引用文献 Discovery of ASTX029, A Clinical Candidate Which Modulates the Phosphorylation and Catalytic Activity of ERK1/2. J.Med.Chem., 64, 2021
7NQQ	Discovery of ASTX029, a clinical candidate which modulates the phosphorylation and catalytic activity of ERK1/2 分子名称: 2-[5-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]-~{N}-[(1~{S})-1-(hydroxymethyl)-2,3-dihydroinden-1-yl]ethanamide, DIMETHYL SULFOXIDE, Mitogen-activated protein kinase 1, ... 著者 O'Reilly, M. 登録日 2021-03-02 公開日 2021-10-06 実験手法 X-RAY DIFFRACTION (1.943 Å) 主引用文献 Discovery of ASTX029, A Clinical Candidate Which Modulates the Phosphorylation and Catalytic Activity of ERK1/2. J.Med.Chem., 64, 2021
7NQW	Discovery of ASTX029, a clinical candidate which modulates the phosphorylation and catalytic activity of ERK1/2 分子名称: 6-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-2-[2-oxidanylidene-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethyl]-3~{H}-isoindol-1-one, DIMETHYL SULFOXIDE, Mitogen-activated protein kinase 1, ... 著者 O'Reilly, M. 登録日 2021-03-02 公開日 2021-10-06 実験手法 X-RAY DIFFRACTION (1.775 Å) 主引用文献 Discovery of ASTX029, A Clinical Candidate Which Modulates the Phosphorylation and Catalytic Activity of ERK1/2. J.Med.Chem., 64, 2021
7E73	Crystal structure of human ERK2 mutant (Y36H) 分子名称: Mitogen-activated protein kinase 1, SULFATE ION 著者 Park, Y.S, Kim, M, Ryu, S.E. 登録日 2021-02-25 公開日 2022-03-02 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2.28 Å) 主引用文献 Structural mechanism of inhibitor-resistance by ERK2 mutations Biodesign, 9, 2021
7E75	Crystal structure of human ERK2 mutant (G37C) 分子名称: Mitogen-activated protein kinase 1 著者 Park, Y.S, Kim, M, Ryu, S.E. 登録日 2021-02-25 公開日 2022-03-02 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2.481 Å) 主引用文献 Structural mechanism of inhibitor-resistance by ERK2 mutations Biodesign, 9, 2021
7AUV	The structure of ERK2 in complex with dual inhibitor ASTX029 分子名称: (2~{R})-2-[5-[5-chloranyl-2-(oxan-4-ylamino)pyrimidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]-~{N}-[(1~{S})-1-(3-fluoranyl-5-methoxy-phenyl)-2-oxidanyl-ethyl]propanamide, DIMETHYL SULFOXIDE, Mitogen-activated protein kinase 1, ... 著者 O'Reilly, M. 登録日 2020-11-03 公開日 2021-10-06 最終更新日 2021-10-13 実験手法 X-RAY DIFFRACTION (1.76 Å) 主引用文献 ASTX029, a Novel Dual-mechanism ERK Inhibitor, Modulates Both the Phosphorylation and Catalytic Activity of ERK. Mol.Cancer Ther., 20, 2021
7ASL	HIV-1 Gag immature lattice. GagSP1T8I 分子名称: Gag protein 著者 Mendonca, L, Zhang, P. 登録日 2020-10-27 公開日 2021-06-23 最終更新日 2022-03-23 実験手法 ELECTRON MICROSCOPY (4.5 Å) 主引用文献 CryoET structures of immature HIV Gag reveal six-helix bundle. Commun Biol, 4, 2021
7ASH	HIV-1 Gag immature lattice. GagdeltaMASP1T8I 分子名称: Gag protein 著者 Mendonca, L, Zhang, P. 登録日 2020-10-27 公開日 2021-06-23 最終更新日 2022-03-23 実験手法 ELECTRON MICROSCOPY (4.2 Å) 主引用文献 CryoET structures of immature HIV Gag reveal six-helix bundle. Commun Biol, 4, 2021
7JUV	Crystal Structure of KSR2:MEK1 in complex with AMP-PNP, and allosteric MEK inhibitor APS-9-95-1 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 2, MAGNESIUM ION, ... 著者 Khan, Z.M, Dar, A.C, Scopton, A.P. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.36 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JV0	Crystal Structure of KSR1:MEK1 in complex with AMP-PNP, and allosteric MEK inhibitor PD0325901 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 1, MAGNESIUM ION, ... 著者 Khan, Z.M, Dar, A.C. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.63 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JUT	Crystal Structure of KSR2:MEK1 in complex with ANP-PNP, and allosteric MEK inhibitor Selumetinib 分子名称: 5-[(4-bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide, Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 2, ... 著者 Khan, Z.M, Dar, A.C. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.09 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JUS	Crystal Structure of KSR2:MEK1 in complex with AMP-PNP, and allosteric MEK inhibitor Cobimetinib 分子名称: Cobimetinib, Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 2, ... 著者 Khan, Z.M, Dar, A.C. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.99 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JV1	Crystal Structure of KSR1:MEK1 in complex with AMP-PNP, and allosteric MEK inhibitor APS-9-95-1 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 1, MAGNESIUM ION, ... 著者 Khan, Z.M, Dar, A.C, Scopton, A.P. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.62 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JUW	Crystal Structure of KSR1:MEK1 in complex with AMP-PNP 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 1, MAGNESIUM ION, ... 著者 Khan, Z.M, Dar, A.C. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.88 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JUZ	Crystal Structure of KSR1:MEK1 in complex with AMP-PNP, and allosteric MEK inhibitor Selumetinib 分子名称: 5-[(4-bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide, Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 1, ... 著者 Khan, Z.M, Dar, A.C. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.21 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JUY	Crystal Structure of KSR1:MEK1 in complex with AMP-PNP, and allosteric MEK inhibitor Cobimetinib 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 1, MAGNESIUM ION, ... 著者 Khan, Z.M, Dar, A.C. 登録日 2020-08-20 公開日 2020-10-07 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.096 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JUQ	Crystal Structure of KSR2:MEK1 in complex with ADP 分子名称: ADENOSINE-5'-DIPHOSPHATE, Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 2, ... 著者 Khan, Z.M, Dar, A.C. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.22 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020
7JUR	Crystal Structure of KSR2:MEK1 in complex with AMP-PNP, and allosteric MEK inhibitor Trametinib 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, Kinase suppressor of Ras 2, MAGNESIUM ION, ... 著者 Khan, Z.M, Dar, A.C. 登録日 2020-08-20 公開日 2020-09-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.82 Å) 主引用文献 Structural basis for the action of the drug trametinib at KSR-bound MEK. Nature, 588, 2020

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