PDB: 970 件ウェブページステータス検索Chemie searchBIRD

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5BX7	PKA in complex with a benzothiophene fragment compound. 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 1,2-ETHANEDIOL, 1-benzothiophen-3-ylmethanol, ... 著者 Narayanan, D, Alam, K.A, Engh, R.A. 登録日 2015-06-08 公開日 2016-09-14 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 PKA based studies of ligand interactions with a methionine gatekeeper. To Be Published
5BX6	PKA in complex with a halogenated phthalazinone fragment compound. 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 4-chlorophthalazin-1(2H)-one, cAMP-dependent protein kinase catalytic subunit alpha, ... 著者 Narayanan, D, Alam, K.A, Engh, R.A. 登録日 2015-06-08 公開日 2016-09-14 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 PKA based studies of ligand interactions with a methionine gatekeeper. To Be Published
5V9G	Structure of the H477R variant of rat cytosolic PEPCK in complex with oxalate and GTP. 分子名称: GUANOSINE-5'-TRIPHOSPHATE, MANGANESE (II) ION, OXALATE ION, ... 著者 Holyoak, T, Cui, D.S. 登録日 2017-03-23 公開日 2017-04-12 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Asymmetric Anchoring Is Required for Efficient Omega-Loop Opening and Closing in Cytosolic Phosphoenolpyruvate Carboxykinase. Biochemistry, 56, 2017
5UZK	Crystal Structure of PKA bound to an pyrrolo pyridine inhibitor 分子名称: 2-{3-[3-(piperidin-4-yl)propoxy]phenyl}-N-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazol-2-yl]acetamide, cAMP-dependent protein kinase catalytic subunit alpha, cAMP-dependent protein kinase inhibitor alpha 著者 Jacobs, M.D, Brown, K. 登録日 2017-02-26 公開日 2018-03-07 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 ROCK inhibitors 3: Design, synthesis and structure-activity relationships of 7-azaindole-based Rho kinase (ROCK) inhibitors. Bioorg. Med. Chem. Lett., 28, 2018
5UZ7	Volta phase plate cryo-electron microscopy structure of a calcitonin receptor-heterotrimeric Gs protein complex 分子名称: Calcitonin receptor, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, ... 著者 Liang, Y.L, Khoshouei, M, Radjainia, M, Zhang, Y, Glukhova, A, Tarrasch, J, Thal, D.M, Furness, S.G.B, Christopoulos, G, Coudrat, T, Danev, R, Baumeister, W, Miller, L.J, Christopoulos, A, Kobilka, B.K, Wootten, D, Skiniotis, G, Sexton, P.M. 登録日 2017-02-24 公開日 2017-05-03 最終更新日 2018-07-18 実験手法 ELECTRON MICROSCOPY (4.1 Å) 主引用文献 Phase-plate cryo-EM structure of a class B GPCR-G-protein complex. Nature, 546, 2017
5V9H	Structure of the H477R variant of rat cytosolic PEPCK in complex with phosphoglycolate and GDP. 分子名称: 2-PHOSPHOGLYCOLIC ACID, GUANOSINE-5'-DIPHOSPHATE, MANGANESE (II) ION, ... 著者 Holyoak, T, Cui, D.S. 登録日 2017-03-23 公開日 2017-04-12 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 Asymmetric Anchoring Is Required for Efficient Omega-Loop Opening and Closing in Cytosolic Phosphoenolpyruvate Carboxykinase. Biochemistry, 56, 2017
5V95	Structure of the H477R variant of rat cytosolic PEPCK in complex with manganese. 分子名称: MANGANESE (II) ION, Phosphoenolpyruvate carboxykinase, cytosolic [GTP], ... 著者 Holyoak, T, Cui, D.S. 登録日 2017-03-23 公開日 2017-04-12 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Asymmetric Anchoring Is Required for Efficient Omega-Loop Opening and Closing in Cytosolic Phosphoenolpyruvate Carboxykinase. Biochemistry, 56, 2017
5V9F	Structure of the H477R variant of rat cytosolic PEPCK in complex with beta sulfopyruvate and GTP. 分子名称: GUANOSINE-5'-TRIPHOSPHATE, MANGANESE (II) ION, Phosphoenolpyruvate carboxykinase, ... 著者 Holyoak, T, Cui, D.S. 登録日 2017-03-23 公開日 2017-04-12 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.05 Å) 主引用文献 Asymmetric Anchoring Is Required for Efficient Omega-Loop Opening and Closing in Cytosolic Phosphoenolpyruvate Carboxykinase. Biochemistry, 56, 2017
5V97	Structure of the H477R variant of rat cytosolic PEPCK in complex with GTP. 分子名称: GUANOSINE-5'-TRIPHOSPHATE, MANGANESE (II) ION, Phosphoenolpyruvate carboxykinase, ... 著者 Holyoak, T, Cui, D.S. 登録日 2017-03-23 公開日 2017-04-12 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Asymmetric Anchoring Is Required for Efficient Omega-Loop Opening and Closing in Cytosolic Phosphoenolpyruvate Carboxykinase. Biochemistry, 56, 2017
6SOX	Crystal structure of cAMP-dependent protein kinase A (CHO PKA) in complex with 4-carbamoylbenzoic acid 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 4-aminocarbonylbenzoic acid, DIMETHYL SULFOXIDE, ... 著者 Oebbeke, M, Siefker, C, Heine, A, Klebe, G. 登録日 2019-08-30 公開日 2020-09-09 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.38 Å) 主引用文献 Fragment Binding to Kinase Hinge: If Charge Distribution and Local pK a Shifts Mislead Popular Bioisosterism Concepts. Angew.Chem.Int.Ed.Engl., 60, 2021
6SPS	Crystal structure of cAMP-dependent protein kinase A (CHO PKA) in complex with 4-(trifluoromethyl)benzamide 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 4-(trifluoromethyl)benzamide, DIMETHYL SULFOXIDE, ... 著者 Oebbeke, M, Siefker, C, Heine, A, Klebe, G. 登録日 2019-09-02 公開日 2020-09-30 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Fragment Binding to Kinase Hinge: If Charge Distribution and Local pK a Shifts Mislead Popular Bioisosterism Concepts. Angew.Chem.Int.Ed.Engl., 60, 2021
6SNX	Crystal structure of cAMP-dependent protein kinase A (CHO PKA) in complex with benzamide 分子名称: BENZAMIDE, cAMP-dependent protein kinase catalytic subunit alpha 著者 Oebbeke, M, Siefker, C, Heine, A, Klebe, G. 登録日 2019-08-27 公開日 2020-09-09 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Fragment Binding to Kinase Hinge: If Charge Distribution and Local pK a Shifts Mislead Popular Bioisosterism Concepts. Angew.Chem.Int.Ed.Engl., 60, 2021
6SPY	Crystal structure of cAMP-dependent protein kinase A (CHO PKA) in complex with 6-(morpholin-4-yl)pyridine-3-carboxamide 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 6-morpholin-4-ylpyridine-3-carboxamide, DIMETHYL SULFOXIDE, ... 著者 Oebbeke, M, Siefker, C, Heine, A, Klebe, G. 登録日 2019-09-03 公開日 2020-09-30 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Fragment Binding to Kinase Hinge: If Charge Distribution and Local pK a Shifts Mislead Popular Bioisosterism Concepts. Angew.Chem.Int.Ed.Engl., 60, 2021
6SNN	Crystal structure of cAMP-dependent protein kinase A (CHO PKA) in complex with benzoic acid 分子名称: BENZOIC ACID, cAMP-dependent protein kinase catalytic subunit alpha 著者 Oebbeke, M, Merkl, S, Siefker, C, Heine, A, Klebe, G. 登録日 2019-08-27 公開日 2020-09-09 最終更新日 2020-12-30 実験手法 X-RAY DIFFRACTION (1.817 Å) 主引用文献 Fragment Binding to Kinase Hinge: If Charge Distribution and Local pK a Shifts Mislead Popular Bioisosterism Concepts. Angew.Chem.Int.Ed.Engl., 60, 2021
6SPM	Crystal structure of cAMP-dependent protein kinase A (CHO PKA) in complex with 4-(trifluoromethyl)benzoic acid 分子名称: 4-(trifluoromethyl)benzoic acid, DIMETHYL SULFOXIDE, METHANOL, ... 著者 Oebbeke, M, Siefker, C, Heine, A, Klebe, G. 登録日 2019-09-02 公開日 2020-09-30 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.37 Å) 主引用文献 Fragment Binding to Kinase Hinge: If Charge Distribution and Local pK a Shifts Mislead Popular Bioisosterism Concepts. Angew.Chem.Int.Ed.Engl., 60, 2021
6SPU	Crystal structure of cAMP-dependent protein kinase A (CHO PKA) in complex with 3-aminobenzoic acid 分子名称: 3-AMINOBENZOIC ACID, DIMETHYL SULFOXIDE, cAMP-dependent protein kinase catalytic subunit alpha 著者 Oebbeke, M, Siefker, C, Heine, A, Klebe, G. 登録日 2019-09-02 公開日 2020-09-30 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.39 Å) 主引用文献 Fragment Binding to Kinase Hinge: If Charge Distribution and Local pK a Shifts Mislead Popular Bioisosterism Concepts. Angew.Chem.Int.Ed.Engl., 60, 2021
6SQ1	Crystal structure of cAMP-dependent Protein Kinase A (CHO PKA) in complex with Aminofasudil 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 5-(1,4-diazepan-1-ylsulfonyl)isoquinolin-1-amine, DIMETHYL SULFOXIDE, ... 著者 Oebbeke, M, Siefker, C, Heine, A, Klebe, G. 登録日 2019-09-03 公開日 2020-09-30 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.49 Å) 主引用文献 A crystallographic study of cAMP-dependent Protein Kinase A in complex with different Fasudil-derivatives To Be Published
6U4S	wild type cysteine dioxygenase 分子名称: Cysteine dioxygenase type 1, FE (III) ION 著者 Meneely, K.M, Chilton, A.S, Forbes, D.L, Ellis, H.R, Lamb, A.L. 登録日 2019-08-26 公開日 2020-07-08 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.49 Å) 主引用文献 The 3-His Metal Coordination Site Promotes the Coupling of Oxygen Activation to Cysteine Oxidation in Cysteine Dioxygenase. Biochemistry, 59, 2020
6U1M	Resting state of rat cysteine dioxygenase R60E variant 分子名称: Cysteine dioxygenase type 1, FE (III) ION 著者 Pinkney, H.R, Fellner, M, Wilbanks, S.M. 登録日 2019-08-16 公開日 2019-10-30 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.61 Å) 主引用文献 Resting state of rat cysteine dioxygenase R60E variant To be Published
6U4L	cysteine dioxygenase variant - C93E 分子名称: ACETATE ION, Cysteine dioxygenase type 1, FE (III) ION 著者 Meneely, K.M, Chilton, A.S, Forbes, D.L, Ellis, H.R, Lamb, A.L. 登録日 2019-08-26 公開日 2020-07-08 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.911 Å) 主引用文献 The 3-His Metal Coordination Site Promotes the Coupling of Oxygen Activation to Cysteine Oxidation in Cysteine Dioxygenase. Biochemistry, 59, 2020
6UJR	P-glycoprotein mutant-F724A and C952A-with BDE100 分子名称: 2,4-dibromophenyl 2,4,6-tribromophenyl ether, ATP-dependent translocase ABCB1 著者 Aller, S.G, Le, C.A. 登録日 2019-10-03 公開日 2020-05-27 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (4.1 Å) 主引用文献 Structural definition of polyspecific compensatory ligand recognition by P-glycoprotein. Iucrj, 7, 2020
6UJT	P-glycoprotein mutant-Y303A and C952A-with BDE100 分子名称: 2,4-dibromophenyl 2,4,6-tribromophenyl ether, ATP-dependent translocase ABCB1 著者 Aller, S.G, Le, C.A. 登録日 2019-10-03 公開日 2020-05-27 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (4.17 Å) 主引用文献 Structural definition of polyspecific compensatory ligand recognition by P-glycoprotein. Iucrj, 7, 2020
6UJW	P-glycoprotein mutant-Y306A and C952A-with BDE100 分子名称: 2,4-dibromophenyl 2,4,6-tribromophenyl ether, ATP-dependent translocase ABCB1 著者 Aller, S.G, Le, C.A. 登録日 2019-10-03 公開日 2020-05-27 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (4.15 Å) 主引用文献 Structural definition of polyspecific compensatory ligand recognition by P-glycoprotein. Iucrj, 7, 2020
7EPT	Structural basis for the tethered peptide activation of adhesion GPCRs 分子名称: Adhesion G-protein coupled receptor D1, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, ... 著者 Ping, Y.-Q, Xiao, P, Yang, F, Zhao, R.-J, Guo, S.-C, Yan, X, Wu, X, Liebscher, I, Xu, H.E, Sun, J.-P. 登録日 2021-04-27 公開日 2022-05-11 実験手法 ELECTRON MICROSCOPY (3 Å) 主引用文献 Structural basis for the tethered peptide activation of adhesion GPCRs. Nature, 604, 2022
7JVP	Cryo-EM structure of SKF-83959-bound dopamine receptor 1 in complex with Gs protein 分子名称: (1R)-6-chloro-3-methyl-1-(3-methylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol, CHOLESTEROL, D(1A) dopamine receptor, ... 著者 Zhuang, Y, Xu, P, Mao, C, Wang, L, Krumm, B, Zhou, X.E, Huang, S, Liu, H, Cheng, X, Huang, X.-P, Sheng, D.-D, Xu, T, Liu, Y.-F, Wang, Y, Guo, J, Jiang, Y, Jiang, H, Melcher, K, Roth, B.L, Zhang, Y, Zhang, C, Xu, H.E. 登録日 2020-08-22 公開日 2021-02-24 最終更新日 2021-03-03 実験手法 ELECTRON MICROSCOPY (2.9 Å) 主引用文献 Structural insights into the human D1 and D2 dopamine receptor signaling complexes. Cell, 184, 2021

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