PDB: 37044 件ウェブページステータス検索Chemie searchBIRD

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5KKI	1.7-Angstrom in situ Mylar structure of hen egg-white lysozyme (HEWL) at 100 K 分子名称: 3,6,9,12,15,18,21,24-OCTAOXAHEXACOSAN-1-OL, ACETIC ACID, CHLORIDE ION, ... 著者 Broecker, J, Ernst, O.P. 登録日 2016-06-21 公開日 2017-02-15 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 A Versatile System for High-Throughput In Situ X-ray Screening and Data Collection of Soluble and Membrane-Protein Crystals. Cryst Growth Des, 16, 2016
8JO4	Cryo-EM structure of a Legionella effector complexed with actin and ATP 分子名称: ADENOSINE-5'-TRIPHOSPHATE, Actin, alpha skeletal muscle, ... 著者 Zhou, X.T, Wang, X.F, Tan, J.X, Zhu, Y.Q. 登録日 2023-06-07 公開日 2024-05-01 最終更新日 2024-07-24 実験手法 ELECTRON MICROSCOPY (3.04 Å) 主引用文献 Legionella effector LnaB is a phosphoryl AMPylase that impairs phosphosignalling. Nature, 631, 2024
8JO3	Cryo-EM structure of a Legionella effector complexed with actin and AMP 分子名称: ADENOSINE MONOPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, Actin, ... 著者 Zhou, X.T, Wang, X.F, Tan, J.X, Zhu, Y.Q. 登録日 2023-06-07 公開日 2024-05-01 最終更新日 2024-07-24 実験手法 ELECTRON MICROSCOPY (2.66 Å) 主引用文献 Legionella effector LnaB is a phosphoryl AMPylase that impairs phosphosignalling. Nature, 631, 2024
7MX3	Crystal structure of human RIPK3 complexed with GSK'843 分子名称: 1,2-ETHANEDIOL, 3-(1,3-benzothiazol-5-yl)-7-(1,3-dimethyl-1H-pyrazol-5-yl)thieno[3,2-c]pyridin-4-amine, Receptor-interacting serine/threonine-protein kinase 3 著者 Davies, K.A, Czabotar, P.E. 登録日 2021-05-18 公開日 2021-11-24 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (3.23 Å) 主引用文献 Human RIPK3 maintains MLKL in an inactive conformation prior to cell death by necroptosis. Nat Commun, 12, 2021
7UCS	The Crystal Structure of Domain-Swapped Dimer Q108K:T51D:A28C:L36C:F57:H:H:H:R58 Mutant of hCRBPII with Histidine Insertion in the Hinge Loop Region at 1.92 Angstrom Resolution 分子名称: Retinol-binding protein 2 著者 Ghanbarpour, A, Geiger, J. 登録日 2022-03-17 公開日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.92 Å) 主引用文献 The Crystal Structure of Domain-Sawpped Dimer Q108K:T51D:A28C:L36C:F57:H:R58 Mutant of hCRBPII with a Histidine Insertion in the Hinge Loop Region at 1.96 Angstrom Resolution To Be Published
6B80	Crystal structure of myotoxin II from Bothrops moojeni complexed to myristic acid 分子名称: 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, Basic phospholipase A2 homolog 2, MYRISTIC ACID, ... 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 (1.949 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
7UCT	The Crystal Structure of Apo Domain-Swapped Dimer F57:H:H:H:H:H:H:R58 Mutant of HCRBPII with Histidine Insertion in the Hinge Loop Region at 2.5 Angstrom Resolution 分子名称: Retinol-binding protein 2 著者 Ghanbarpour, A, Geiger, J. 登録日 2022-03-17 公開日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.52 Å) 主引用文献 The Crystal Structure of Domain-Sawpped Dimer Q108K:T51D:A28C:L36C:F57:H:R58 Mutant of hCRBPII with a Histidine Insertion in the Hinge Loop Region at 1.96 Angstrom Resolution To Be Published
7UD3	The Crystal Structure of Domain-Swapped Dimer Q108K:T51D:A28C:L36C:F57:W:W:W:R58 Mutant of hCRBPII with a Histidine Insertion in the Hinge Loop Region at 2.36 Angstrom Resolution 分子名称: Retinol-binding protein 2 著者 Ghanbarpour, A, Geiger, J. 登録日 2022-03-17 公開日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.37 Å) 主引用文献 The Crystal Structure of Domain-Sawpped Dimer Q108K:T51D:A28C:L36C:F57:H:R58 Mutant of hCRBPII with a Histidine Insertion in the Hinge Loop Region at 1.96 Angstrom Resolution To Be Published
7UCV	The Crystal Structure of Apo Domain-Swapped Dimer Q108K:T51D:A28CL36C R58:H:H:H:N59 HCRBPII with Histidine Insertion in the Hinge Loop Region at 2.19 Angstrom Resolution 分子名称: Retinol-binding protein 2 著者 Ghanbarpour, A, Geiger, J. 登録日 2022-03-17 公開日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.19 Å) 主引用文献 The Crystal Structure of Domain-Sawpped Dimer Q108K:T51D:A28C:L36C:F57:H:R58 Mutant of hCRBPII with a Histidine Insertion in the Hinge Loop Region at 1.96 Angstrom Resolution To Be Published
5KPK	Glycogen Synthase Kinase 3 beta Complexed with BRD0209 分子名称: (4~{S})-3-cyclopropyl-4,7,7-trimethyl-4-phenyl-2,6,8,9-tetrahydropyrazolo[3,4-b]quinolin-5-one, Glycogen synthase kinase-3 beta 著者 Lakshminarasimhan, D, White, A, Nadupalli, A, Suto, R.K. 登録日 2016-07-04 公開日 2018-03-14 最終更新日 2018-03-21 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Exploiting an Asp-Glu "switch" in glycogen synthase kinase 3 to design paralog-selective inhibitors for use in acute myeloid leukemia. Sci Transl Med, 10, 2018
6BD5	Crystal structure of human CYP3A4 bound to an inhibitor 分子名称: Cytochrome P450 3A4, PROTOPORPHYRIN IX CONTAINING FE, tert-butyl (2-{[(2R)-2-(cyclopentylamino)-3-oxo-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}ethyl)carbamate 著者 Sevrioukova, I. 登録日 2017-10-21 公開日 2017-12-13 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Inhibition of Human CYP3A4 by Rationally Designed Ritonavir-Like Compounds: Impact and Interplay of the Side Group Functionalities. Mol Pharm., 15, 2018
7UCZ	The Crystal Structure of Apo Monomer F57:H:H:H:H:H:H:R58 Mutant of HCRBPII with Histidine Insertion in the Hinge Loop Region at 1.1 Angstrom Resolution 分子名称: Retinol-binding protein 2 著者 Ghanbarpour, A, Geiger, J. 登録日 2022-03-17 公開日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.08 Å) 主引用文献 The Crystal Structure of Domain-Sawpped Dimer Q108K:T51D:A28C:L36C:F57:H:R58 Mutant of hCRBPII with a Histidine Insertion in the Hinge Loop Region at 1.96 Angstrom Resolution To Be Published
7UD1	The Crystal Structure of Apo Monomer F57:H:H:H:R58 HCRBPII with Histidine Insertion in the Hinge Loop Region at 1.3 Angstrom Resolution 分子名称: Retinol-binding protein 2 著者 Ghanbarpour, A, Geiger, J. 登録日 2022-03-17 公開日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.32 Å) 主引用文献 The Crystal Structure of Apo Monomer F57:H:H:H:R58 HCRBPII with Histidine Insertion in the Hinge Loop Region at 1.3 Angstrom Resolution To Be Published
7UCN	The Crystal Structure of Domain-Swapped Dimer Q108K:T51D:A28C:L36C:F57:H:R58 Mutant of hCRBPII with a Histidine Insertion in the Hinge Loop Region at 1.96 Angstrom Resolution 分子名称: Retinol-binding protein 2 著者 Ghanbarpour, A, Geiger, J. 登録日 2022-03-16 公開日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.96 Å) 主引用文献 The Crystal Structure of Domain-Sawpped Dimer Q108K:T51D:A28C:L36C:F57:H:R58 Mutant of hCRBPII with a Histidine Insertion in the Hinge Loop Region at 1.96 Angstrom Resolution To Be Published
8EGI	X-ray structure of carbonmonoxy hemoglobin in complex with VZHE039-NO 分子名称: CARBON MONOXIDE, Hemoglobin subunit alpha, Hemoglobin subunit beta, ... 著者 Donkor, A.K, Musayev, F.N, Safo, M.K. 登録日 2022-09-12 公開日 2022-11-16 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Design, Synthesis, and Investigation of Novel Nitric Oxide (NO)-Releasing Aromatic Aldehydes as Drug Candidates for the Treatment of Sickle Cell Disease. Molecules, 27, 2022
5KQY	Protease E35D-DRV 分子名称: (3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE, Protease E35D-DRV 著者 Liu, Z, Poole, K.M, Mahon, B.P, McKenna, R, Fanucci, G.E. 登録日 2016-07-06 公開日 2016-09-21 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Effects of Hinge-region Natural Polymorphisms on Human Immunodeficiency Virus-Type 1 Protease Structure, Dynamics, and Drug Pressure Evolution. J.Biol.Chem., 291, 2016
8JY0	Crystal structure of RhoBAST complexed with TMR-DN 分子名称: 2,4-dinitroaniline, 5-aminocarbonyl-2-[3-(dimethylamino)-6-dimethylazaniumylidene-xanthen-9-yl]benzoate, GUANOSINE-5'-DIPHOSPHATE, ... 著者 Zhang, Y, Xiao, Y, Xu, Z, Fang, X. 登録日 2023-07-02 公開日 2024-05-29 実験手法 X-RAY DIFFRACTION (2.75 Å) 主引用文献 Structural mechanisms for binding and activation of a contact-quenched fluorophore by RhoBAST. Nat Commun, 15, 2024
6BFN	Crystal structure of human IRAK1 分子名称: Interleukin-1 receptor-associated kinase 1, N-[2-methoxy-4-(morpholin-4-yl)phenyl]-6-(1H-pyrazol-5-yl)pyridine-2-carboxamide 著者 Wang, L, Qiao, Q, Wu, H. 登録日 2017-10-26 公開日 2017-12-06 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.26 Å) 主引用文献 Crystal structure of human IRAK1. Proc. Natl. Acad. Sci. U.S.A., 114, 2017
6B1Q	Hydrogen Bonding Complementary, not size complementarity is key in the formation of the double helix 分子名称: DNA (5'-D(*CP*TP*TP*AP*TP*(CJ1)P*(CJ1)P*(CJ1))-3'), DNA (5'-D(P*(1AP)P*(1AP)P*(1AP)P*AP*TP*AP*AP*G)-3'), Reverse transcriptase 著者 Singh, I, Georgiadis, M.M. 登録日 2017-09-18 公開日 2018-09-19 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 "Skinny" and "Fat" DNA: Two New Double Helices. J. Am. Chem. Soc., 140, 2018
6B36	Crystal Structure of HIV Protease complexed with (S)-N-(3-fluoro-2-(2-(1-(phenylsulfonyl)piperazin-2-yl)ethyl)phenyl)-3,3-bis(4-fluorophenyl)propanamide 分子名称: (S)-N-(3-fluoro-2-(2-(1-(phenylsulfonyl)piperazin-2-yl)ethyl)phenyl)-3,3-bis(4-fluorophenyl)propanamide, CHLORIDE ION, HIV-1 Protease 著者 Su, H.P. 登録日 2017-09-21 公開日 2018-01-03 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.63 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
5KTH	Structure of cow mincle complexed with brartemicin 分子名称: 2,4-dihydroxy-6-methyl Benzoic acid, CALCIUM ION, TRIETHYLENE GLYCOL, ... 著者 Feinberg, H, Rambaruth, N.D.S, Jegouzo, S.A.F, Jacobsen, K.M, Djurhuus, R, Poulsen, T.B, Taylor, M.E, Drickamer, K, Weis, W.I. 登録日 2016-07-11 公開日 2016-08-31 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.21 Å) 主引用文献 Binding Sites for Acylated Trehalose Analogs of Glycolipid Ligands on an Extended Carbohydrate Recognition Domain of the Macrophage Receptor Mincle. J.Biol.Chem., 291, 2016
5L2Q	Serine/threonine-protein kinase 40 (STK40) kinase homology domain 分子名称: Serine/threonine-protein kinase 40 著者 Durzynska, I, Uljon, S, Blacklow, S.C. 登録日 2016-08-02 公開日 2017-02-01 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.53 Å) 主引用文献 STK40 Is a Pseudokinase that Binds the E3 Ubiquitin Ligase COP1. Structure, 25, 2017
6B3C	Crystal Structure of HIV Protease complexed with N-(3-fluoro-2-(2-((2S,6R)-6-methyl-1-(phenylsulfonyl)piperazin-2-yl)ethyl)phenyl)-3,3-bis(4-fluorophenyl)propanamide 分子名称: CHLORIDE ION, HIV-1 Protease, N-(3-fluoro-2-{2-[(2S,5R)-5-methyl-1-(phenylsulfonyl)piperazin-2-yl]ethyl}phenyl)-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 (1.6 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
5L3H	Re-refinement of 4dd4; cisplatin coordination chemistry determination at hen egg white lysozyme His15 with standard uncertainties 分子名称: AMMONIA, CHLORIDE ION, DIMETHYL SULFOXIDE, ... 著者 Helliwell, J.R, Tanley, S.W.M. 登録日 2016-05-06 公開日 2016-06-15 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Cisplatin coordination chemistry determination at hen egg white lysozyme His15 with ligand distances and angles, and their standard uncertainties, and also reporting a split occupancy effect ArXiv, 2016
5KU8	Crystal structure of CK2 分子名称: 1,2-ETHANEDIOL, Casein kinase II subunit alpha, SULFATE ION, ... 著者 Ferguson, A.D, Dowling, J. 登録日 2016-07-13 公開日 2017-11-08 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.22 Å) 主引用文献 Crystal structure of CK2 Not Published

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