PDB: 37273 件ウェブページステータス検索Chemie searchBIRD

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8U2M	Structure of P450Blt from Micromonospora sp. MW-13 in Complex with Biarylitide 分子名称: 2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXYL, ACETATE ION, Cytochrome P450-SU1, ... 著者 Hansen, M.H, Cryle, M.J. 登録日 2023-09-06 公開日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.79 Å) 主引用文献 Structural Insights into a Side Chain Cross-Linking Biarylitide P450 from RiPP Biosynthesis Acs Catalysis, 2024
7TLK	Crystal Structure of K-Ras(G12S) 分子名称: GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION 著者 Ziyang, Z, Guiley, K.Z, Shokat, K.M. 登録日 2022-01-18 公開日 2022-08-03 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.71102226 Å) 主引用文献 Chemical acylation of an acquired serine suppresses oncogenic signaling of K-Ras(G12S). Nat.Chem.Biol., 18, 2022
5WNG	X-RAY CO-STRUCTURE OF RHO-ASSOCIATED PROTEIN KINASE (ROCK1) WITH A HIGHLY SELECTIVE INHIBITOR 分子名称: (2R)-N-(3-cyanophenyl)-2-(3-{[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]carbamoyl}phenyl)pyrrolidine-1-carboxamide, Rho-associated protein kinase 1 著者 Li, X. 登録日 2017-07-31 公開日 2018-08-01 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.9 Å) 主引用文献 Novel mechanism of Rho kinase selectivity: beyond the ATP pocket To Be Published
4PDC	Crystal structure of Cowpox virus CPXV018 (OMCP) bound to human NKG2D 分子名称: CPXV018 protein, NKG2-D type II integral membrane protein 著者 Lazear, E, Nelson, C.A, Fremont, D.H, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2014-04-17 公開日 2014-05-21 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.991 Å) 主引用文献 Structural basis of cowpox evasion of NKG2D immunosurveillance Biorxiv, 2019
4YGZ	CRYSTAL STRUCTURE OF THE R111K:Y134F:T54V:R132Q:P39Y:R59Y MUTANT OF HUMAN CELLULAR RETINOIC ACID BINDING PROTEIN II WITH RETINAL AT 2.06 ANGSTROM RESOLUTION - VISIBLE LIGHT IRRADIATED CRYSTAL -3RD CYCLE 分子名称: Cellular retinoic acid-binding protein 2, RETINAL 著者 Nosrati, M, Geiger, J.H. 登録日 2015-02-26 公開日 2016-03-02 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.06 Å) 主引用文献 A Photoisomerizing Rhodopsin Mimic Observed at Atomic Resolution. J.Am.Chem.Soc., 138, 2016
5WBT	Solution Structure and Dynamics of an Ultra-Stable Single-Chain Insulin Analog STUDIES OF AN ENGINEERED MONOMER AND IMPLICATIONS FOR RECEPTOR BINDING 分子名称: Insulin 著者 Glidden, M.D, Yang, Y, Wickramasinghe, N.P, Weiss, M.A. 登録日 2017-06-29 公開日 2017-11-15 最終更新日 2023-06-14 実験手法 SOLUTION NMR 主引用文献 Solution structure of an ultra-stable single-chain insulin analog connects protein dynamics to a novel mechanism of receptor binding. J. Biol. Chem., 293, 2018
8FVZ	PiPT Y150A 分子名称: CITRATE ANION, PHOSPHATE ION, Phosphate transporter 著者 Gupta, M, Finer-Moore, J, Stroud, R.M. 登録日 2023-01-20 公開日 2024-01-03 実験手法 X-RAY DIFFRACTION (3.1 Å) 主引用文献 Roles of PiPT residues in phosphate binding and transport tested by mutagenesis To be published
6B3H	Crystal Structure of HIV Protease complexed with N-(2-(2-((6R,9S)-2,2-dioxido-2-thia-1,7-diazabicyclo[4.3.1]decan-9-yl)ethyl)-3-fluorophenyl)-3,3-bis(4-fluorophenyl)propanamide 分子名称: CHLORIDE ION, HIV-1 Protease, N-(2-{2-[(6R,9S)-2,2-dioxo-2lambda~6~-thia-1,7-diazabicyclo[4.3.1]decan-9-yl]ethyl}-3-fluorophenyl)-3,3-bis(4-fluorophenyl)propanamide 著者 Su, H.P. 登録日 2017-09-21 公開日 2018-01-03 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.62 Å) 主引用文献 Design and Synthesis of Piperazine Sulfonamide Cores Leading to Highly Potent HIV-1 Protease Inhibitors. ACS Med Chem Lett, 8, 2017
8E54	MicroED structure of triclinic lysozyme recorded on K3 分子名称: Lysozyme C, NITRATE ION 著者 Clabbers, M.T.B, Martynowycz, M.W, Hattne, J, Nannenga, B.L, Gonen, T. 登録日 2022-08-19 公開日 2022-09-21 最終更新日 2022-10-19 実験手法 ELECTRON CRYSTALLOGRAPHY (1.2 Å) 主引用文献 Electron-counting MicroED data with the K2 and K3 direct electron detectors. J.Struct.Biol., 214, 2022
6RT3	Native tetragonal lysozyme - synchrotron data 分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysozyme C, ... 著者 Pereira, P.J.B. 登録日 2019-05-22 公開日 2019-06-05 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.05 Å) 主引用文献 Protein crystals as a key for deciphering macromolecular crowding effects on biological reactions. Phys Chem Chem Phys, 22, 2020
7TLG	Crystal Structure of small molecule beta-lactone 5 covalently bound to K-Ras(G12S) 分子名称: (3R,4R)-1-[7-(8-chloronaphthalen-1-yl)-8-fluoro-2-{[(4S,7as)-tetrahydro-1H-pyrrolizin-7a(5H)-yl]methoxy}pyrido[4,3-d]pyrimidin-4-yl]-3-hydroxypiperidine-4-carbaldehyde, GTPase KRas, GUANOSINE-5'-DIPHOSPHATE, ... 著者 Ziyang, Z, Guiley, K.Z, Shokat, K.M. 登録日 2022-01-18 公開日 2022-08-03 最終更新日 2024-10-09 実験手法 X-RAY DIFFRACTION (1.80000722 Å) 主引用文献 Chemical acylation of an acquired serine suppresses oncogenic signaling of K-Ras(G12S). Nat.Chem.Biol., 18, 2022
5WDQ	H-Ras mutant L120A bound to GMP-PNP at 100K 分子名称: ACETATE ION, CALCIUM ION, GTPase HRas, ... 著者 Bandaru, P, Gee, C.L, Kuriyan, J. 登録日 2017-07-05 公開日 2017-07-19 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.25 Å) 主引用文献 Deconstruction of the Ras switching cycle through saturation mutagenesis. Elife, 6, 2017
6S7N	Crystal structure of orthorhombic lysozyme grown at pH 5.5 with a 26% of solvent content 分子名称: Lysozyme C, SULFATE ION 著者 Camara-Artigas, A, Plaza-Garrido, M, Salinas-Garcia, M.C. 登録日 2019-07-05 公開日 2019-11-20 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.2 Å) 主引用文献 Major conformational changes in the structure of lysozyme obtained from a crystal with a very low solvent content. Acta Crystallogr.,Sect.F, 75, 2019
4YLB	Crystal Structure of A102D mutant of hsp14.1 from Sulfolobus solfatataricus P2 分子名称: CHLORIDE ION, Heat shock protein Hsp20 著者 Liu, L, Chen, J.Y, Yun, C.H. 登録日 2015-03-05 公開日 2015-11-04 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.501 Å) 主引用文献 Active-State Structures of a Small Heat-Shock Protein Revealed a Molecular Switch for Chaperone Function Structure, 23, 2015
5WQ0	Receiver domain of Spo0A from Paenisporosarcina sp. TG-14 分子名称: MAGNESIUM ION, Stage 0 sporulation protein 著者 Lee, J.H, Lee, C.W. 登録日 2016-11-22 公開日 2017-03-22 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.604 Å) 主引用文献 Crystal structure of the inactive state of the receiver domain of Spo0A from Paenisporosarcina sp. TG-14, a psychrophilic bacterium isolated from an Antarctic glacier J. Microbiol., 55, 2017
4PGJ	Human heavy-chain domain antibody in complex with hen egg-white lysozyme 分子名称: Human heavy chain domain antibody, Lysozyme C 著者 Christ, D, Langley, D.B, Rouet, R. 登録日 2014-05-02 公開日 2015-03-11 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Fully Human VH Single Domains That Rival the Stability and Cleft Recognition of Camelid Antibodies. J.Biol.Chem., 290, 2015
6B6S	Orthorhombic trypsin cryocooled to 100 K with 50% ethanol as cryoprotectant 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Juers, D.H. 登録日 2017-10-03 公開日 2017-11-01 最終更新日 2020-01-01 実験手法 X-RAY DIFFRACTION (2.0002284 Å) 主引用文献 The impact of cryosolution thermal contraction on proteins and protein crystals: volumes, conformation and order. Acta Crystallogr D Struct Biol, 74, 2018
6RVG	Co-substituted beta-Keggin bound to Proteinase K solved by MR 分子名称: Co-substituted beta-Keggin, Proteinase K, SULFATE ION 著者 Breibeck, J, Bijelic, A, Rompel, A. 登録日 2019-05-31 公開日 2019-09-18 最終更新日 2024-10-09 実験手法 X-RAY DIFFRACTION (1.1 Å) 主引用文献 Transition metal-substituted Keggin polyoxotungstates enabling covalent attachment to proteinase K upon co-crystallization. Chem.Commun.(Camb.), 55, 2019
4YLJ	Crystal structure of DYRK1A in complex with 10-Iodo-substituted 11H-indolo[3,2-c]quinoline-6-carboxylic acid inhibitor 5j 分子名称: 10-iodo-11H-indolo[3,2-c]quinoline-6-carboxylic acid, Dual specificity tyrosine-phosphorylation-regulated kinase 1A, SULFATE ION, ... 著者 Chaikuad, A, Falke, H, Nowak, R, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Kunick, C, Knapp, S, Structural Genomics Consortium (SGC) 登録日 2015-03-05 公開日 2015-03-25 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (2.58 Å) 主引用文献 10-Iodo-11H-indolo[3,2-c]quinoline-6-carboxylic Acids Are Selective Inhibitors of DYRK1A. J.Med.Chem., 58, 2015
6B81	Crystal structure of Myotoxin II from Bothrops moojeni complexed to Caprylic acid 分子名称: Basic phospholipase A2 homolog 2, OCTANOIC ACID (CAPRYLIC ACID), SULFATE ION 著者 Salvador, G.H.M, dos Santos, J.I, Fontes, M.R.M. 登録日 2017-10-05 公開日 2018-10-03 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.76 Å) 主引用文献 Structural evidence for a fatty acid-independent myotoxic mechanism for a phospholipase A2-like toxin. Biochim Biophys Acta Proteins Proteom, 1866, 2018
5CN6	Ultrafast dynamics in myoglobin: 0.1 ps time delay 分子名称: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Barends, T.R.M, Foucar, L, Ardevol, A, Nass, K.J, Aquila, A, Botha, S, Doak, R.B, Falahati, K, Hartmann, E, Hilpert, M, Heinz, M, Hoffmann, M.C, Koefinger, J, Koglin, J, Kovacsova, G, Liang, M, Milathianaki, D, Lemke, H.T, Reinstein, J, Roome, C.M, Shoeman, R.L, Williams, G.J, Burghardt, I, Hummer, G, Boutet, S, Schlichting, I. 登録日 2015-07-17 公開日 2015-09-16 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Direct observation of ultrafast collective motions in CO myoglobin upon ligand dissociation. Science, 350, 2015
7U8H	Discovery of a KRAS G12V Inhibitor in vivo Tool Compound starting from an HSQC-NMR based Fragment Hit 分子名称: 1H-benzimidazol-2-ylmethanethiol, 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile, GTPase KRas, ... 著者 Phan, J, Fesik, S.W. 登録日 2022-03-08 公開日 2022-11-09 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.702 Å) 主引用文献 Fragment Optimization of Reversible Binding to the Switch II Pocket on KRAS Leads to a Potent, In Vivo Active KRAS G12C Inhibitor. J.Med.Chem., 65, 2022
6S1H	Crystal Structure of DYRK1A with small molecule inhibitor 分子名称: 1,2-ETHANEDIOL, Dual specificity tyrosine-phosphorylation-regulated kinase 1A, SULFATE ION, ... 著者 Sorrell, F.J, Henderson, S.H, Redondo, C, Burgess-Brown, N.A, von Delft, F, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Elkins, J.M. 登録日 2019-06-18 公開日 2019-06-26 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.05 Å) 主引用文献 Kinase Scaffold Repurposing in the Public Domain To be published
5CNB	Ultrafast dynamics in myoglobin: 0.5 ps time delay 分子名称: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Barends, T.R.M, Foucar, L, Ardevol, A, Nass, K.J, Aquila, A, Botha, S, Doak, R.B, Falahati, K, Hartmann, E, Hilpert, M, Heinz, M, Hoffmann, M.C, Koefinger, J, Koglin, J, Kovacsova, G, Liang, M, Milathianaki, D, Lemke, H.T, Reinstein, J, Roome, C.M, Shoeman, R.L, Williams, G.J, Burghardt, I, Hummer, G, Boutet, S, Schlichting, I. 登録日 2015-07-17 公開日 2015-09-16 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Direct observation of ultrafast collective motions in CO myoglobin upon ligand dissociation. Science, 350, 2015
4P2P	AN INDEPENDENT CRYSTALLOGRAPHIC REFINEMENT OF PORCINE PHOSPHOLIPASE A2 AT 2.4 ANGSTROMS RESOLUTION 分子名称: CALCIUM ION, PHOSPHOLIPASE A2 著者 Finzel, B.C, Ohlendorf, D.H, Weber, P.C, Salemme, F.R. 登録日 1991-10-22 公開日 1992-01-15 最終更新日 2017-11-29 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 An independent crystallographic refinement of porcine phospholipase A2 at 2.4 A resolution Acta Crystallogr.,Sect.B, 47, 1991

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