PDB: 73050 件ウェブページステータス検索Chemie searchBIRD

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6WA2	Crystal structure of EGFR(T790M/V948R) in complex with LN3753 分子名称: CHLORIDE ION, Epidermal growth factor receptor, N-(3-{5-[2-(acetylamino)pyridin-4-yl]-2-(methylsulfanyl)-1H-imidazol-4-yl}phenyl)-2-fluoro-5-hydroxybenzamide 著者 Heppner, D.E, Eck, M.J. 登録日 2020-03-24 公開日 2021-03-31 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Design of a "Two-in-One" Mutant-Selective Epidermal Growth Factor Receptor Inhibitor That Spans the Orthosteric and Allosteric Sites. J.Med.Chem., 65, 2022
6WAK	A crystal structure of EGFR(T790M/V948R) in complex with LN3754 分子名称: Epidermal growth factor receptor, MAGNESIUM ION, N-(3-{5-[2-(acetylamino)pyridin-4-yl]-2-(methylsulfanyl)-1H-imidazol-4-yl}phenyl)-2-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]benzamide, ... 著者 Heppner, D.E, Eck, M.J. 登録日 2020-03-25 公開日 2021-03-31 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Design of a "Two-in-One" Mutant-Selective Epidermal Growth Factor Receptor Inhibitor That Spans the Orthosteric and Allosteric Sites. J.Med.Chem., 65, 2022
1PH0	Non-carboxylic Acid-Containing Inhibitor of PTP1B Targeting the Second Phosphotyrosine Site 分子名称: 2-{4-[2-(S)-ALLYLOXYCARBONYLAMINO-3-{4-[(2-CARBOXY-PHENYL)-OXALYL-AMINO]-PHENYL}-PROPIONYLAMINO]-BUTOXY}-6-HYDROXY-BENZ OIC ACID METHYL ESTER, Protein-tyrosine phosphatase, non-receptor type 1 著者 Liu, G, Xin, Z, Liang, H, Abad-Zapatero, C, Hajduk, P, Janowick, D, Szczepankiewicz, B, Pei, Z, Hutchins, C.W, Ballaron, S.J. 登録日 2003-05-29 公開日 2003-07-29 最終更新日 2023-08-16 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Selective Protein Tyrosine Phosphatase 1B Inhibitors: Targeting the Second Phosphotyrosine Binding Site with Non-Carboxylic Acid-Containing Ligands. J.Med.Chem., 46, 2003
2IHR	RF2 of Thermus thermophilus 分子名称: Peptide chain release factor 2 著者 Dobbek, H, Voertler, C.S, Sprinzl, M. 登録日 2006-09-27 公開日 2007-02-20 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Release factors 2 from Escherichia coli and Thermus thermophilus: structural, spectroscopic and microcalorimetric studies. Nucleic Acids Res., 35, 2007
6XZ5	RovC - regulator of virulence interconnected with the Csr system 分子名称: SULFATE ION, Uncharacterized protein,RovC,Uncharacterized protein 著者 Sadana, P, Scrima, A. 登録日 2020-02-02 公開日 2020-09-16 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 RovC - a novel type of hexameric transcriptional activator promoting type VI secretion gene expression. Plos Pathog., 16, 2020
6XVR	Human myelin protein P2 mutant L35S 分子名称: Myelin P2 protein, PALMITIC ACID, SULFATE ION 著者 Ruskamo, S, Lehtimaki, M, Kursula, P. 登録日 2020-01-22 公開日 2020-04-08 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Cryo-EM, X-ray diffraction, and atomistic simulations reveal determinants for the formation of a supramolecular myelin-like proteolipid lattice. J.Biol.Chem., 295, 2020
7ODW	Model of Haliangium ochraceum encapsulin from icosahedral single particle reconstruction 分子名称: Linocin_M18 bacteriocin protein 著者 Marles-Wright, J, Basle, A, Clarke, D.J, Ross, J. 登録日 2021-04-30 公開日 2022-03-09 最終更新日 2024-07-10 実験手法 ELECTRON MICROSCOPY (2.5 Å) 主引用文献 Pore dynamics and asymmetric cargo loading in an encapsulin nanocompartment. Sci Adv, 8, 2022
6ZIO	CRYSTAL STRUCTURE OF NRAS (C118S) IN COMPLEX WITH GDP 分子名称: GTPase NRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION 著者 Kessler, D, Fischer, G, Boettcher, J. 登録日 2020-06-26 公開日 2020-08-19 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Drugging all RAS isoforms with one pocket. Future Med Chem, 12, 2020
7OG5	RNA-free Ribonuclease P from Halorhodospira halophila 分子名称: RNA-free ribonuclease P 著者 Altegoer, F, Bange, G. 登録日 2021-05-06 公開日 2021-07-07 最終更新日 2024-07-10 実験手法 ELECTRON MICROSCOPY (3.37 Å) 主引用文献 Structure and mechanistic features of the prokaryotic minimal RNase P. Elife, 10, 2021
6Y6X	Tetracenomycin X bound to the human ribosome 分子名称: 28S ribosomal RNA, 5.8S ribosomal RNA, 5S ribosomal RNA, ... 著者 Buschauer, R, Cheng, J, Berninghausen, O, Beckmann, R, Wilson, D.N. 登録日 2020-02-27 公開日 2020-07-08 最終更新日 2023-11-08 実験手法 ELECTRON MICROSCOPY (2.8 Å) 主引用文献 Tetracenomycin X inhibits translation by binding within the ribosomal exit tunnel. Nat.Chem.Biol., 16, 2020
7OGG	Nse5/6 complex 分子名称: DNA repair protein KRE29,DNA repair protein KRE29,DNA repair protein KRE29, Non-structural maintenance of chromosome element 5,Non-structural maintenance of chromosome element 5,Non-structural maintenance of chromosome element 5 著者 Basquin, J, Taschner, M, Gruber, S. 登録日 2021-05-06 公開日 2021-07-07 最終更新日 2021-08-11 実験手法 X-RAY DIFFRACTION (3.29 Å) 主引用文献 Nse5/6 inhibits the Smc5/6 ATPase and modulates DNA substrate binding. Embo J., 40, 2021
1OFE	Glutamate Synthase from Synechocystis sp in complex with 2-Oxoglutarate and L-DON at 2.45 Angstrom resolution 分子名称: 2-OXOGLUTARIC ACID, 5-OXO-L-NORLEUCINE, FE3-S4 CLUSTER, ... 著者 Van Den heuvel, R.H.H, Mattevi, A. 登録日 2003-04-14 公開日 2003-06-11 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (2.45 Å) 主引用文献 The Active Conformation of Glutamate Synthase and its Binding to Ferredoxin J.Mol.Biol., 330, 2003
6YUM	CK2 alpha bound to unclosed Macrocycle 分子名称: 4-[5-[2-(2-hydroxyethyloxy)ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-3-yl]-2-oxidanyl-benzoic acid, Casein kinase II subunit alpha, SULFATE ION 著者 Kraemer, A, Hanke, T, Kurz, C, Celik, I, Knapp, S, Structural Genomics Consortium (SGC) 登録日 2020-04-27 公開日 2020-07-01 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.75 Å) 主引用文献 Optimization of pyrazolo[1,5-a]pyrimidines lead to the identification of a highly selective casein kinase 2 inhibitor. Eur.J.Med.Chem., 208, 2020
2IGM	Crystal structure of recombinant pyranose 2-oxidase H548N mutant 分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, FLAVIN-ADENINE DINUCLEOTIDE, Pyranose oxidase 著者 Divne, C. 登録日 2006-09-22 公開日 2006-10-10 最終更新日 2021-10-20 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structural basis for substrate binding and regioselective oxidation of monosaccharides at c3 by pyranose 2-oxidase. J.Biol.Chem., 281, 2006
6Z30	Human cation-independent mannose 6-phosphate/ IGF2 receptor domains 9-10 分子名称: Cation-independent mannose-6-phosphate receptor, alpha-D-mannopyranose-(1-3)-alpha-D-mannopyranose-(1-6)-[alpha-D-mannopyranose-(1-3)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose 著者 Bochel, A.J, Williams, C, Crump, M.P. 登録日 2020-05-19 公開日 2020-08-19 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Structure of the Human Cation-Independent Mannose 6-Phosphate/IGF2 Receptor Domains 7-11 Uncovers the Mannose 6-Phosphate Binding Site of Domain 9. Structure, 28, 2020
1M1M	X-RAY CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS BETA-KETOACYL-ACYL CARRIER PROTEIN SYNTHASE III (MTFABH) 分子名称: 3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE III 著者 Sacchettini, J.C, Sridharan, S, TB Structural Genomics Consortium (TBSGC) 登録日 2002-06-19 公開日 2002-07-17 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Probing the mechanism of the Mycobacterium tuberculosis beta-ketoacyl-acyl carrier protein synthase III mtFabH: factors influencing catalysis and substrate specificity. J.Biol.Chem., 280, 2005
6Z9J	Escherichia coli D-2-deoxyribose-5-phosphate aldolase - N21K mutant 分子名称: Deoxyribose-phosphate aldolase, MAGNESIUM ION 著者 Paakkonen, J, Hakulinen, N, Rouvinen, J. 登録日 2020-06-04 公開日 2020-11-18 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Substrate specificity of 2-deoxy-D-ribose 5-phosphate aldolase (DERA) assessed by different protein engineering and machine learning methods. Appl.Microbiol.Biotechnol., 104, 2020
7O70	KRasG12C ligand complex 分子名称: 1-[(4R,7S)-12-chloro-14-fluoro-13-(2-fluoro-6-hydroxyphenyl)-4-methyl-10-oxa-2,5,16,18-tetrazatetracyclo[9.7.1.0^(2,7).0^(15,19)]nonadeca-1(18),11,13,15(19),16-pentaen-5-en-1-one-yl]prop-2, CALCIUM ION, GTPase KRas, ... 著者 Phillips, C. 登録日 2021-04-12 公開日 2022-04-20 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (1.18 Å) 主引用文献 Discovery of AZD4625, a Covalent Allosteric Inhibitor of the Mutant GTPase KRAS G12C . J.Med.Chem., 65, 2022
7O83	KRasG12C ligand complex 分子名称: 1-[(7S)-11-chloro-12-(5-methyl-1H-indazol-4-yl)-9-oxa-2,5,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10,12,14(18),15-pentaen-5-yl]prop-2-en-1-one, CALCIUM ION, GUANOSINE-5'-DIPHOSPHATE, ... 著者 Phillips, C, Breed, J. 登録日 2021-04-14 公開日 2022-04-20 最終更新日 2022-05-25 実験手法 X-RAY DIFFRACTION (2.38 Å) 主引用文献 Discovery of AZD4625, a Covalent Allosteric Inhibitor of the Mutant GTPase KRAS G12C . J.Med.Chem., 65, 2022
7OAE	Cryo-EM structure of the plectasin fibril (double strands) 分子名称: Fungal defensin plectasin 著者 Effantin, G. 登録日 2021-04-19 公開日 2022-04-27 最終更新日 2022-11-16 実験手法 ELECTRON MICROSCOPY (2 Å) 主引用文献 pH- and concentration-dependent supramolecular assembly of a fungal defensin plectasin variant into helical non-amyloid fibrils. Nat Commun, 13, 2022
2IGN	Crystal structure of recombinant pyranose 2-oxidase H167A mutant 分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, FLAVIN-ADENINE DINUCLEOTIDE, Pyranose oxidase 著者 Divne, C. 登録日 2006-09-22 公開日 2006-10-10 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Structural basis for substrate binding and regioselective oxidation of monosaccharides at c3 by pyranose 2-oxidase. J.Biol.Chem., 281, 2006
7OAG	Cryo-EM structure of the plectasin fibril (single strand) 分子名称: Fungal defensin plectasin 著者 Effantin, G. 登録日 2021-04-19 公開日 2022-04-27 最終更新日 2024-10-16 実験手法 ELECTRON MICROSCOPY (3.4 Å) 主引用文献 pH- and concentration-dependent supramolecular assembly of a fungal defensin plectasin variant into helical non-amyloid fibrils. Nat Commun, 13, 2022
7NQD	Prim-Pol Domain of CRISPR-associated Prim-Pol (CAPP) from Marinitoga sp. 1137 分子名称: TPR_REGION domain-containing protein 著者 Li, A.W.H, Doherty, A.J. 登録日 2021-03-01 公開日 2022-05-04 最終更新日 2024-06-19 実験手法 X-RAY DIFFRACTION (2.97 Å) 主引用文献 Molecular basis for the initiation of DNA primer synthesis. Nature, 605, 2022
7NQE	Prim-Pol Domain of CRISPR-associated Prim-Pol (CAPP) from Marinitoga sp. 1137 with dGTP 分子名称: 1,2-ETHANEDIOL, 2'-DEOXYGUANOSINE-5'-TRIPHOSPHATE, MANGANESE (II) ION, ... 著者 Li, A.W.H, Doherty, A.J. 登録日 2021-03-01 公開日 2022-05-04 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.28 Å) 主引用文献 Molecular basis for the initiation of DNA primer synthesis. Nature, 605, 2022
7NQF	Prim-Pol Domain of CRISPR-associated Prim-Pol (CAPP) from Marinitoga sp. 1137 with dsDNA 分子名称: COBALT (II) ION, DNA(CGTGDG), TPR_REGION domain-containing protein 著者 Li, A.W.H, Doherty, A.J. 登録日 2021-03-01 公開日 2022-05-04 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (2.02 Å) 主引用文献 Molecular basis for the initiation of DNA primer synthesis. Nature, 605, 2022

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