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

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7MBO	FACTOR XIA (PICHIA PASTORIS; C500S [C122S]) IN COMPLEX WITH THE INHIBITOR Milvexian (BMS-986177), IUPAC NAME:(6R,10S)-10-{4-[5-chloro-2-(4-chloro-1H-1,2,3-triazol-1-yl)phenyl]-6- oxopyrimidin-1(6H)-yl}-1-(difluoromethyl)-6-methyl-1,4,7,8,9,10-hexahydro-15,11- (metheno)pyrazolo[4,3-b][1,7]diazacyclotetradecin-5(6H)-one 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Coagulation factor XIa light chain, Milvexian 著者 Sheriff, S. 登録日 2021-04-01 公開日 2021-09-15 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (0.924 Å) 主引用文献 Discovery of Milvexian, a High-Affinity, Orally Bioavailable Inhibitor of Factor XIa in Clinical Studies for Antithrombotic Therapy. J.Med.Chem., 65, 2022
8DZT	Crystal structure of human Sar1aH79G mutant 分子名称: CALCIUM ION, GTP-binding protein SAR1a, GUANOSINE-5',3'-TETRAPHOSPHATE, ... 著者 Huang, Q. 登録日 2022-08-08 公開日 2022-11-30 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 The alarmone ppGpp selectively inhibits the isoform A of the human small GTPase Sar1. Proteins, 91, 2023
8E83	Structure of 2-hydroxyisoflavanone synthase from Medicago truncatula 分子名称: Isoflavone synthase 1, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION 著者 Pan, H, Wang, X. 登録日 2022-08-25 公開日 2022-11-30 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 The protein conformational basis of isoflavone biosynthesis. Commun Biol, 5, 2022
8E0A	Crystal structure of human Sar1b 分子名称: GTP-binding protein SAR1b, GUANOSINE-5'-DIPHOSPHATE, SULFATE ION 著者 Huang, Q. 登録日 2022-08-08 公開日 2022-11-30 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.797 Å) 主引用文献 The alarmone ppGpp selectively inhibits the isoform A of the human small GTPase Sar1. Proteins, 91, 2023
8E0D	Crystal structure of human Sar1bE140D 分子名称: GTP-binding protein SAR1b, GUANOSINE-5',3'-TETRAPHOSPHATE 著者 Huang, Q. 登録日 2022-08-08 公開日 2022-11-30 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.981 Å) 主引用文献 The alarmone ppGpp selectively inhibits the isoform A of the human small GTPase Sar1. Proteins, 91, 2023
7TXE	Plasmodium falciparum Cyt c2 DSD 分子名称: Cytochrome c2, HEME C 著者 Hill, C.P, Wienkers, H.J, Whitby, F.G. 登録日 2022-02-08 公開日 2023-05-10 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Direct tests of cytochrome c and c1 functions in the electron transport chain of malaria parasites Proc Natl Acad Sci U S A, 120, 2023
6KX2	Crystal structure of GDP bound RhoA protein 分子名称: GUANOSINE-5'-DIPHOSPHATE, Transforming protein RhoA 著者 Zhang, H, Luo, C. 登録日 2019-09-09 公開日 2020-08-19 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.454 Å) 主引用文献 Covalent Inhibitors Allosterically Block the Activation of Rho Family Proteins and Suppress Cancer Cell Invasion. Adv Sci, 7, 2020
8J9B	LnaB-actin binary complex 分子名称: Actin gamma 1, Type IV secretion protein Dot 著者 Chen, T.T, Ouyang, S.Y. 登録日 2023-05-03 公開日 2024-05-08 実験手法 X-RAY DIFFRACTION (3.42 Å) 主引用文献 Structure of Legionella effector LnaB-actin binary complex To Be Published
7U2V	Plasmodium falciparum Cyt c2 DSD 分子名称: Cytochrome c2, HEME C 著者 Hill, C.P, Wienkers, H.J, Whitby, F.G. 登録日 2022-02-24 公開日 2023-05-10 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 Direct tests of cytochrome c and c1 functions in the electron transport chain of malaria parasites Proc Natl Acad Sci U S A, 120, 2023
6AG9	Crystal structure of uPA in complex with 3,5-bis(azanyl)-6-(1-benzofuran-2-yl)-N-carbamimidoyl-pyrazine-2- carboxamide 分子名称: 3,5-bis(azanyl)-6-(1-benzofuran-2-yl)-N-carbamimidoyl-pyrazine-2-carboxamide, SULFATE ION, Urokinase-type plasminogen activator 著者 Buckley, B, Jiang, L.G, Majed, H, Huang, M.D, Kelso, M, Ranson, M. 登録日 2018-08-09 公開日 2019-09-18 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.63 Å) 主引用文献 uPA-HMA To Be Published
8E0H	Crystal structure of human Sar1aD104/D140A double mutant 分子名称: GTP-binding protein SAR1a, GUANOSINE-5',3'-TETRAPHOSPHATE 著者 Huang, Q. 登録日 2022-08-09 公開日 2022-11-30 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 The alarmone ppGpp selectively inhibits the isoform A of the human small GTPase Sar1. Proteins, 91, 2023
8DZO	Crystal structure of human Sar1T39N mutant 分子名称: CALCIUM ION, GTP-binding protein SAR1a, GUANOSINE-5',3'-TETRAPHOSPHATE, ... 著者 Huang, Q. 登録日 2022-08-08 公開日 2022-11-30 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 The alarmone ppGpp selectively inhibits the isoform A of the human small GTPase Sar1. Proteins, 91, 2023
5K2N	lysozyme with nano particles 分子名称: Lysozyme C 著者 Ko, S, Choe, J. 登録日 2016-05-19 公開日 2017-05-31 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Crystal Structure of Lysozyme To Be Published
6AC2	Crystal Structure of HEWL at pH 2.2 分子名称: ACETATE ION, CHLORIDE ION, Lysozyme C, ... 著者 Seyedarabi, A, Seraj, Z. 登録日 2018-07-24 公開日 2019-07-31 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.23 Å) 主引用文献 Cinnamaldehyde and Phenyl Ethyl Alcohol promote the entrapment of intermediate species of HEWL, as revealed by structural, kinetics and thermal stability studies. Sci Rep, 9, 2019
8EA0	CryoEM structure of miniGq-coupled hM3R in complex with iperoxo (local refinement) 分子名称: 4-(4,5-dihydro-1,2-oxazol-3-yloxy)-N,N,N-trimethylbut-2-yn-1-aminium, CHOLESTEROL HEMISUCCINATE, Muscarinic acetylcholine receptor M3 著者 Zhang, S, Fay, J.F, Roth, B.L. 登録日 2022-08-27 公開日 2022-11-30 最終更新日 2022-12-21 実験手法 ELECTRON MICROSCOPY (2.56 Å) 主引用文献 Molecular basis for selective activation of DREADD-based chemogenetics. Nature, 612, 2022
6KX3	Crystal structure of RhoA protein with covalent inhibitor DC-Rhoin 分子名称: GUANOSINE-5'-DIPHOSPHATE, Transforming protein RhoA, prop-2-enyl (3R)-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophene-3-carboxylate 著者 Zhang, H, Luo, C. 登録日 2019-09-09 公開日 2020-08-19 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.981 Å) 主引用文献 Covalent Inhibitors Allosterically Block the Activation of Rho Family Proteins and Suppress Cancer Cell Invasion. Adv Sci, 7, 2020
6KZS	Crystal structure of cytochrome P450mel 107F1 in complex with heme and imidazole 分子名称: Cytochrome P-450, IMIDAZOLE, PROTOPORPHYRIN IX CONTAINING FE 著者 Hou, X.D, Rao, Y.J, Icyishaka, P, Li, C.X, Lou, J.L. 登録日 2019-09-25 公開日 2020-09-23 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.601 Å) 主引用文献 Crystallization and X-ray analysis of cytochrome P450mel 107F1 with biaryl coupling reactivity To Be Published
5K5J	Homo sapiens CCCTC-binding factor (CTCF) ZnF5-8 and DNA complex structure in space group P41212 分子名称: ACETATE ION, DNA (5'-D(*CP*CP*CP*TP*GP*CP*TP*GP*GP*CP*AP*AP*C)-3'), DNA (5'-D(*TP*TP*GP*CP*CP*AP*GP*CP*AP*GP*GP*GP*G)-3'), ... 著者 Hashimoto, H, Cheng, X. 登録日 2016-05-23 公開日 2017-05-24 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.287 Å) 主引用文献 Structural Basis for the Versatile and Methylation-Dependent Binding of CTCF to DNA. Mol. Cell, 66, 2017
7MPH	GRB2 SH2 Domain with Compound 7 分子名称: (4-{(10R,11E,14S,18S)-18-(2-amino-2-oxoethyl)-14-[(naphthalen-1-yl)methyl]-8,17,20-trioxo-7,16,19-triazaspiro[5.14]icos-11-en-10-yl}phenyl)acetic acid, 1,2-ETHANEDIOL, Growth factor receptor-bound protein 2, ... 著者 Sun, L, Schonbrunn, E. 登録日 2021-05-04 公開日 2021-09-22 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Synthesis and structural characterization of a monocarboxylic inhibitor for GRB2 SH2 domain. Bioorg.Med.Chem.Lett., 51, 2021
7TY1	Crystal structure of apo eosinophil cationic protein (ribonuclease 3) from Macaca fascicularis (MfECP) 分子名称: CITRIC ACID, DI(HYDROXYETHYL)ETHER, Eosinophil cationic protein, ... 著者 Tran, T.T.Q, Pham, N.T.H, Calmettes, C, Doucet, N. 登録日 2022-02-11 公開日 2023-08-16 最終更新日 2024-05-29 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Ancestral sequence reconstruction dissects structural and functional differences among eosinophil ribonucleases. J.Biol.Chem., 300, 2024
5K7O	MicroED structure of lysozyme at 1.8 A resolution 分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION 著者 de la Cruz, M.J, Hattne, J, Shi, D, Seidler, P, Rodriguez, J, Reyes, F.E, Sawaya, M.R, Cascio, D, Eisenberg, D, Gonen, T. 登録日 2016-05-26 公開日 2017-04-05 最終更新日 2018-08-22 実験手法 ELECTRON CRYSTALLOGRAPHY (1.8 Å) 主引用文献 Atomic-resolution structures from fragmented protein crystals with the cryoEM method MicroED. Nat. Methods, 14, 2017
6L1Z	Crystal structure of CK2a1 with hematein 分子名称: (6aR)-3,4,6a,10-tetrakis(oxidanyl)-6,7-dihydroindeno[2,1-c]chromen-9-one, Casein Kinase 2 subunit alpha 著者 Tsuyuguchi, M, Kinoshita, T. 登録日 2019-10-02 公開日 2020-02-26 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.90820944 Å) 主引用文献 Structural insights for producing CK2 alpha 1-specific inhibitors. Bioorg.Med.Chem.Lett., 30, 2020
6AL3	Lys49 PLA2 BPII derived from the venom of Protobothrops flavoviridis. 分子名称: Basic phospholipase A2 BP-II, SULFATE ION 著者 Matsui, T, Kamata, S, Suzuki, A, Oda-Ueda, N, Ogawa, T, Tanaka, Y. 登録日 2018-09-05 公開日 2019-01-16 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.57 Å) 主引用文献 SDS-induced oligomerization of Lys49-phospholipase A2from snake venom. Sci Rep, 9, 2019
6AHH	Crystal Structure of HEWL in complex with Phenylethyl alcohol (in the aroma form) after 5 hours under fibrillation conditions 分子名称: 2-PHENYL-ETHANOL, CHLORIDE ION, Lysozyme C, ... 著者 Seraj, Z, Seyedarabi, A. 登録日 2018-08-18 公開日 2019-08-28 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Cinnamaldehyde and Phenyl Ethyl Alcohol promote the entrapment of intermediate species of HEWL, as revealed by structural, kinetics and thermal stability studies. Sci Rep, 9, 2019
6L1A	Crystal Structure of P450BM3 with N-enanthoyl-L-prolyl-L-phenylalanine 分子名称: (2S)-2-[[(2S)-1-heptanoylpyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid, Bifunctional cytochrome P450/NADPH--P450 reductase, DIMETHYL SULFOXIDE, ... 著者 Shoji, O, Yonemura, K. 登録日 2019-09-28 公開日 2020-09-30 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.84 Å) 主引用文献 Systematic Evolution of Decoy Molecules for the Highly Efficient Hydroxylation of Benzene and Small Alkanes Catalyzed by Wild-Type Cytochrome P450BM3 Acs Catalysis, 10, 2020

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