PDB: 245011 件ウェブページステータス検索Chemie searchBIRD

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4LQZ	Crystal structure of a DUF4909 family protein (SAV1798) from Staphylococcus aureus subsp. aureus Mu50 at 1.92 A resolution 分子名称: CHLORIDE ION, PHOSPHATE ION, Uncharacterized protein 著者 Joint Center for Structural Genomics (JCSG) 登録日 2013-07-19 公開日 2013-08-07 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.92 Å) 主引用文献 Crystal structure of a hypothetical protein (SAV1798) from Staphylococcus aureus subsp. aureus Mu50 at 1.92 A resolution To be published
6Q0U	Structure of the Erbin PDZ variant E-6a with a high-affinity C-terminal peptide 分子名称: 1,2-ETHANEDIOL, Erbin, peptide 著者 Singer, A.U, Teyra, J, Ernst, A, Sicheri, F, Sidhu, S.S. 登録日 2019-08-02 公開日 2019-11-13 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 Comprehensive analysis of all evolutionary paths between two divergent PDZ domain specificities. Protein Sci., 29, 2020
6GHD	Structural analysis of the ternary complex between lamin A/C, BAF and emerin identifies an interface disrupted in autosomal recessive progeroid diseases 分子名称: 1,2-ETHANEDIOL, Barrier-to-autointegration factor, Emerin, ... 著者 Samson, C, Petitalot, A, Celli, F, Herrada, I, Ropars, V, Ledu, M.H, Nhiri, N, Arteni, A.A, Buendia, B, ZinnJustin, S. 登録日 2018-05-07 公開日 2018-08-08 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Structural analysis of the ternary complex between lamin A/C, BAF and emerin identifies an interface disrupted in autosomal recessive progeroid diseases. Nucleic Acids Res., 46, 2018
5ZFJ	Crystal structure of a cyclase Filc from Fischerella sp. in complex with 4-(1H-Indol-3-yl)butan-2-one 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 4-(1~{H}-indol-3-yl)butan-2-one, CALCIUM ION, ... 著者 Hu, X.Y, Liu, W.D, Chen, C.C, Guo, R.T. 登録日 2018-03-06 公開日 2018-12-19 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.86 Å) 主引用文献 The Crystal Structure of a Class of Cyclases that Catalyze the Cope Rearrangement Angew. Chem. Int. Ed. Engl., 57, 2018
6D5W	Ras:SOS:Ras in complex with a small molecule activator 分子名称: 10-[(4-fluorophenyl)methyl]-2,3,4,10-tetrahydropyrimido[1,2-a]benzimidazole, GTPase HRas, MAGNESIUM ION, ... 著者 Phan, J, Hodges, T, Fesik, S.W. 登録日 2018-04-19 公開日 2019-03-27 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.478 Å) 主引用文献 Discovery and Structure-Based Optimization of Benzimidazole-Derived Activators of SOS1-Mediated Nucleotide Exchange on RAS. J. Med. Chem., 61, 2018
7BZL	GH127 beta-L-arabinofuranosidase HypBA1 covalently complexed with beta-L-arabinofuranose-configured cyclophellitol 分子名称: (1S,2S,3R,4R)-3-(hydroxymethyl)cyclopentane-1,2,4-triol, Non-reducing end beta-L-arabinofuranosidase, ZINC ION 著者 Amaki, S, McGregor, N.G.S, Arakawa, T, Yamada, C, Borlandelli, V, Overkleeft, H.S, Davies, G.J, Fushinobu, S. 登録日 2020-04-28 公開日 2021-01-27 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Cysteine Nucleophiles in Glycosidase Catalysis: Application of a Covalent beta-l-Arabinofuranosidase Inhibitor. Angew.Chem.Int.Ed.Engl., 60, 2021
5EPL	Crystal Structure of chromodomain of CBX4 in complex with inhibitor UNC3866 分子名称: E3 SUMO-protein ligase CBX4, UNKNOWN ATOM OR ION, unc3866 著者 Liu, Y, Tempel, W, Walker, J.R, Stuckey, J.I, Dickson, B.M, James, L.I, Frye, S.V, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Min, J, Structural Genomics Consortium (SGC) 登録日 2015-11-11 公開日 2015-12-23 最終更新日 2025-04-02 実験手法 X-RAY DIFFRACTION (1.81 Å) 主引用文献 A cellular chemical probe targeting the chromodomains of Polycomb repressive complex 1. Nat.Chem.Biol., 12, 2016
6GIH	Crystal Structure of CK2alpha with CAM187 bound 分子名称: ACETATE ION, Casein kinase II subunit alpha, [3-chloranyl-5-(1~{H}-indol-4-yl)phenyl]methanamine 著者 Brear, P, Iegre, J, North, A, De Fusco, C, Georgiou, K, Lubin, A, Carro, L, Sore, H, Hyvonen, M, Spring, D. 登録日 2018-05-11 公開日 2018-05-23 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.96 Å) 主引用文献 Novel non-ATP competitive small molecules targeting the CK2 alpha / beta interface. Bioorg. Med. Chem., 26, 2018
9HUB	D11 mAbs bound to alpha-Bungarotoxin at pH 7.5 分子名称: 1,2-ETHANEDIOL, Alpha-bungarotoxin, heavy chain, ... 著者 Wade, J.W, Bohn, M.F, Laustsen, A.H, Morth, J.P. 登録日 2024-12-21 公開日 2025-11-19 実験手法 X-RAY DIFFRACTION (1.33 Å) 主引用文献 Rational design of antibodies with pH-dependent antigen-binding properties using structural insights from broadly neutralizing antibodies against alpha-neurotoxins. Mabs, 17, 2025
6K8X	Crystal structure of a class C beta lactamase 分子名称: Beta-lactamase 著者 Bae, D.W, Jung, Y.E, An, Y.J, Na, J.H, Cha, S.S. 登録日 2019-06-13 公開日 2019-10-16 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.59 Å) 主引用文献 Structural Insights into Catalytic Relevances of Substrate Poses in ACC-1. Antimicrob.Agents Chemother., 63, 2019
7D9Q	Crystal Structure of Recombinant Human Acetylcholinesterase in Complex with Compound 7 分子名称: (2S)-2-[[4-fluoranyl-1-[(3-fluorophenyl)methyl]piperidin-4-yl]methyl]-5,6-dimethoxy-2,3-dihydroinden-1-one, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Acetylcholinesterase 著者 Liu, Q.F, Yin, W.C. 登録日 2020-10-14 公開日 2021-08-25 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (2.66 Å) 主引用文献 Kinetics-Driven Drug Design Strategy for Next-Generation Acetylcholinesterase Inhibitors to Clinical Candidate. J.Med.Chem., 64, 2021
7SZA	Crystal Structure Analysis of human PRPK complex with a compound 分子名称: 4-amino-2-[(3R)-2,6-dioxopiperidin-3-yl]-1H-isoindole-1,3(2H)-dione, CITRATE ANION, EKC/KEOPS complex subunit TP53RK, ... 著者 Seo, H.-S, Dhe-Paganon, S. 登録日 2021-11-27 公開日 2023-01-25 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Development of PRPK Directed Phthalimides Biorxiv, 2021
5A8M	Crystal structure of the selenomethionine derivative of beta-glucanase SdGluc5_26A from Saccharophagus degradans 分子名称: CHLORIDE ION, GLYCEROL, MAGNESIUM ION, ... 著者 Sulzenbacher, G, Lafond, M, Freyd, T, Henrissat, B, Coutinho, R.M, Berrin, J.G, Garron, M.L. 登録日 2015-07-16 公開日 2016-01-20 最終更新日 2024-10-16 実験手法 X-RAY DIFFRACTION (1.86 Å) 主引用文献 The Quaternary Structure of a Glycoside Hydrolase Dictates Specificity Towards Beta-Glucans J.Biol.Chem., 291, 2016
5X3J	Kfla1895 D451A mutant in complex with cyclobis-(1->6)-alpha-nigerosyl 分子名称: Cyclic alpha-D-glucopyranose-(1-3)-alpha-D-glucopyranose-(1-6)-alpha-D-glucopyranose-(1-3)-alpha-D-glucopyranose, GLYCEROL, Glycoside hydrolase family 31, ... 著者 Tanaka, Y, Chen, M, Tagami, T, Yao, M, Kimura, A. 登録日 2017-02-06 公開日 2018-02-07 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Glycoside hydrolase mutant in complex with substrate To Be Published
4XKX	Crystal structure of BACE1 in complex with 2-aminooxazoline 3-azaxanthene inhibitor 28 分子名称: (5S)-7-(2-fluoropyridin-3-yl)-3-(2-fluoropyridin-4-yl)spiro[chromeno[2,3-c]pyridine-5,4'-[1,3]oxazol]-2'-amine, Beta-secretase 1, GLYCEROL, ... 著者 Whittington, D.A, Long, A.M. 登録日 2015-01-12 公開日 2015-02-04 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Development of 2-aminooxazoline 3-azaxanthenes as orally efficacious beta-secretase inhibitors for the potential treatment of Alzheimer's disease. Bioorg.Med.Chem.Lett., 25, 2015
5F0J	Structure of retromer VPS26-VPS35 subunits bound to SNX3 分子名称: 1,2-ETHANEDIOL, GLYCEROL, SULFATE ION, ... 著者 Lucas, M, Gershlick, D, Vidaurrazaga, A, Rojas, A.L, Bonifacino, J.S, Hierro, A. 登録日 2015-11-27 公開日 2016-12-07 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Structural Mechanism for Cargo Recognition by the Retromer Complex. Cell, 167, 2016
5EU6	HLA Class I antigen 分子名称: 1,2-ETHANEDIOL, Beta-2-microglobulin, GLYCEROL, ... 著者 Rizkallah, P.J, Bianchi, V, Cole, D.K, Sewell, A.K. 登録日 2015-11-18 公開日 2016-03-02 最終更新日 2024-10-09 実験手法 X-RAY DIFFRACTION (2.02 Å) 主引用文献 A Molecular Switch Abrogates Glycoprotein 100 (gp100) T-cell Receptor (TCR) Targeting of a Human Melanoma Antigen. J.Biol.Chem., 291, 2016
5EU4	HLA Class I antigen 分子名称: 1,2-ETHANEDIOL, Beta-2-microglobulin, GLYCEROL, ... 著者 Rizkallah, P.J, Bianchi, V, Cole, D.K, Sewell, A.K. 登録日 2015-11-18 公開日 2016-03-02 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2.12 Å) 主引用文献 A Molecular Switch Abrogates Glycoprotein 100 (gp100) T-cell Receptor (TCR) Targeting of a Human Melanoma Antigen. J.Biol.Chem., 291, 2016
4LV5	Murine IRGa6 bound to Toxoplasma ROP5B, a pseudokinase GDI 分子名称: 1,2-ETHANEDIOL, ADENOSINE-5'-DIPHOSPHATE, BETA-MERCAPTOETHANOL, ... 著者 Reese, M.L, Boothroyd, J.C. 登録日 2013-07-25 公開日 2013-09-25 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Murine IRGa6 bound to Toxoplasma ROP5B, a pseudokinase GDI To be Published
4M4D	Crystal structure of lipopolysaccharide binding protein 分子名称: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 2-acetamido-2-deoxy-beta-D-glucopyranose, Lipopolysaccharide-binding protein 著者 Eckert, J.K, Kim, Y.J, Kim, J.I, Gurtler, K, Oh, D.Y, Ploeg, A.H, Pickkers, P, Lundvall, L, Hamann, L, Giamarellos-Bourboulis, E, Kubarenko, A.V, Weber, A.N, Kabesch, M, Kumpf, O, An, H.J, Lee, J.O, Schumann, R.R. 登録日 2013-08-07 公開日 2013-10-30 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (2.909 Å) 主引用文献 The crystal structure of lipopolysaccharide binding protein reveals the location of a frequent mutation that impairs innate immunity. Immunity, 39, 2013
9HCY	Crystal structure of human TRF1 TRFH domain in complex with compound 54 分子名称: 1,2-ETHANEDIOL, 2-(4-ethylphenoxy)-1-piperidin-1-yl-ethanone, CALCIUM ION, ... 著者 Casale, G, Le Bihan, Y.-V, van Montfort, R.L.M, Guettler, S. 登録日 2024-11-11 公開日 2025-11-19 実験手法 X-RAY DIFFRACTION (1.93 Å) 主引用文献 Discovery of first-in-class inhibitors of the TRF1-TIN2 protein-protein interaction by fragment screening To Be Published
9HD0	Crystal structure of human TRF1 TRFH domain in complex with compound 55 分子名称: 1,2-ETHANEDIOL, 2-(4-ethylphenoxy)-1-piperidin-1-yl-ethanone, CALCIUM ION, ... 著者 Casale, G, Le Bihan, Y.-V, van Montfort, R.L.M, Guettler, S. 登録日 2024-11-11 公開日 2025-11-19 実験手法 X-RAY DIFFRACTION (1.93 Å) 主引用文献 Discovery of first-in-class inhibitors of the TRF1-TIN2 protein-protein interaction by fragment screening To Be Published
5ZTY	Crystal structure of human G protein coupled receptor 分子名称: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, DI(HYDROXYETHYL)ETHER, ... 著者 Li, X.T, Hua, T, Wu, L.J, Liu, Z.J. 登録日 2018-05-05 公開日 2019-01-30 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Crystal Structure of the Human Cannabinoid Receptor CB2 Cell, 176, 2019
8R20	X-ray crystallographic structure of KstA15, polyketide biosynthesis enzyme 分子名称: GLYCEROL, Hydroxylase 著者 Schnell, R, Schneider, G. 登録日 2023-11-02 公開日 2024-08-07 最終更新日 2024-08-14 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Mechanism of Two-Component Mono-Oxygenases Involved in Anthracycline 1-Hydroxylation Acs Catalysis, 2024
4M65	In situ thermolysin crystallized on a MiTeGen micromesh with asparagine ligand 分子名称: 1,2-ETHANEDIOL, ASPARAGINE, CALCIUM ION, ... 著者 Yin, X, Scalia, A, Leroy, L, Cuttitta, C.M, Polizzo, G.M, Ericson, D.L, Roessler, C.G, Campos, O, Agarwal, R, Allaire, M, Orville, A.M, Jackimowicz, R, Ma, M.Y, Sweet, R.M, Soares, A.S. 登録日 2013-08-08 公開日 2013-10-30 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Hitting the target: fragment screening with acoustic in situ co-crystallization of proteins plus fragment libraries on pin-mounted data-collection micromeshes Acta Crystallogr.,Sect.D, D70

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