PDB: 36840 件ウェブページステータス検索Chemie searchBIRD

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4R93	BACE-1 in complex with (R)-4-(2-cyclohexylethyl)-1-methyl-5-oxo-4-(((1S,3R)-3-(3-phenylureido)cyclohexyl)methyl)imidazolidin-2-iminium 分子名称: 1-[(1R,3S)-3-{[(2E,4R)-4-(2-cyclohexylethyl)-2-imino-1-methyl-5-oxoimidazolidin-4-yl]methyl}cyclohexyl]-3-phenylurea, Beta-secretase 1, L(+)-TARTARIC ACID 著者 Orth, P, Strickland, C, Caldwell, J.P. 登録日 2014-09-03 公開日 2014-11-05 最終更新日 2014-12-17 実験手法 X-RAY DIFFRACTION (1.71 Å) 主引用文献 Discovery of potent iminoheterocycle BACE1 inhibitors. Bioorg.Med.Chem.Lett., 24, 2014
4RFP	Crystal structure of a acidic PLA2 from Trimeresurus stejnegeri venom 分子名称: Acidic phospholipase A2 5, DI(HYDROXYETHYL)ETHER 著者 Zeng, F, Niu, L, Li, X, Teng, M. 登録日 2014-09-26 公開日 2014-10-15 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Crystal structure of a acidic PLA2 from Trimeresurus stejnegeri venom To be Published
4RA8	Structure analysis of the Mip1a P8A mutant 分子名称: C-C motif chemokine 3 著者 Liang, W.G, Ren, M, Guo, Q, Tang, W.J. 登録日 2014-09-09 公開日 2014-09-24 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Structures of human CCL18, CCL3, and CCL4 reveal molecular determinants for quaternary structures and sensitivity to insulin-degrading enzyme. J.Mol.Biol., 427, 2015
4QYF	CHK1 kinase domain in complex with aminopyrazine compound 13 分子名称: 4-[3-amino-6-(3-hydroxyphenyl)pyrazin-2-yl]benzoic acid, Serine/threonine-protein kinase Chk1 著者 Appleton, B, Wu, P. 登録日 2014-07-24 公開日 2014-12-17 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 Discovery of the 1,7-diazacarbazole class of inhibitors of checkpoint kinase 1. Bioorg.Med.Chem.Lett., 24, 2014
4QYN	The Crystal Structures of holo-wt human Cellular Retinol Binding protein II (hCRBPII) bound to Retinol 分子名称: ACETATE ION, RETINOL, Retinol-binding protein 2 著者 Nossoni, Z, Assar, Z, Yapici, I, Nosrati, M, Wang, W, Berbasova, T, Vasileiou, C, Borhan, B, Geiger, H. 登録日 2014-07-24 公開日 2014-12-31 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.19 Å) 主引用文献 Structures of holo wild-type human cellular retinol-binding protein II (hCRBPII) bound to retinol and retinal. Acta Crystallogr.,Sect.D, 70, 2014
4RCK	Crystal Structure of Uncharacterized Membrane Spanning Protein from Vibrio fischeri 分子名称: Hypothetical membrane spanning protein, MAGNESIUM ION 著者 Kim, Y, Tesar, C, Bearden, J, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) 登録日 2014-09-16 公開日 2014-11-26 実験手法 X-RAY DIFFRACTION (2.999 Å) 主引用文献 Crystal Structure of Uncharacterized Membrane Spanning Protein from Vibrio fischeri To be Published
4QYW	Structure of phosphono-CheY from T.maritima 分子名称: Chemotaxis protein CheY 著者 Beyersdorf, M.S, Sircar, R, Crane, B.R, Halkides, C.J. 登録日 2014-07-25 公開日 2015-08-19 最終更新日 2019-07-17 実験手法 X-RAY DIFFRACTION (1.597 Å) 主引用文献 Isolation, Phosphonomethylation, and Crystallization of phosphono-CheY from Thermotoga maritima To be Published
6NCG	Crystal Structure of Human Vaccinia-related kinase 2 (VRK-2) bound to pyridin-benzenesulfonamide inhibitor 分子名称: 4-[6-amino-5-(3,5-difluoro-4-hydroxyphenyl)pyridin-3-yl]benzene-1-sulfonamide, SULFATE ION, Serine/threonine-protein kinase VRK2 著者 dos Reis, C.V, Chiodi, C.G, de Souza, G.P, Guimaraes, C, Mascarello, A, Gama, F, Ferreira, M, Counago, R.M, Massirer, K.B, Elkins, J.M, Arruda, P, Edwards, A.M, Structural Genomics Consortium (SGC) 登録日 2018-12-11 公開日 2019-01-16 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.45 Å) 主引用文献 Crystal Structure of Human Vaccinia-related kinase 2 (VRK-2) bound to pyridin-benzenesulfonamide inhibitor To Be Published
4QZT	Crystal Structure of wild type Human Cellular Retinol Binding Protein II (hCRBPII) bound to retinol at 7 KeV beam energy 分子名称: ACETATE ION, RETINOL, Retinol-binding protein 2 著者 Assar, Z, Geiger, J.H. 登録日 2014-07-28 公開日 2014-12-10 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structures of holo wild-type human cellular retinol-binding protein II (hCRBPII) bound to retinol and retinal. Acta Crystallogr.,Sect.D, 70, 2014
4R0F	Structure of Lysozyme Dimer at 318K 分子名称: GLYCEROL, Lysozyme C 著者 Sharma, P, Ashish 登録日 2014-07-31 公開日 2015-07-22 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.941 Å) 主引用文献 Characterization of heat induced spherulites of lysozyme reveals new insight on amyloid initiation. Sci Rep, 6, 2016
4RCF	Crystal structure of BACE1 in complex with 2-aminooxazoline 4-fluoroxanthene inhibitor 49 分子名称: (4S)-2'-(3,6-dihydro-2H-pyran-4-yl)-4'-fluoro-7'-(2-fluoropyridin-3-yl)spiro[1,3-oxazole-4,9'-xanthen]-2-amine, Beta-secretase 1, GLYCEROL, ... 著者 Whittington, D.A, Long, A.M. 登録日 2014-09-15 公開日 2014-12-24 最終更新日 2017-11-22 実験手法 X-RAY DIFFRACTION (1.78 Å) 主引用文献 Lead Optimization and Modulation of hERG Activity in a Series of Aminooxazoline Xanthene beta-Site Amyloid Precursor Protein Cleaving Enzyme (BACE1) Inhibitors. J.Med.Chem., 57, 2014
6NFZ	Crystal structure of diphosphorylated HPK1 kinase domain in complex with sunitinib in the active state. 分子名称: Mitogen-activated protein kinase kinase kinase kinase 1, N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide 著者 Johnson, E, McTigue, M, Cronin, C.N. 登録日 2018-12-21 公開日 2019-05-01 最終更新日 2019-06-26 実験手法 X-RAY DIFFRACTION (2.966 Å) 主引用文献 Multiple conformational states of the HPK1 kinase domain in complex with sunitinib reveal the structural changes accompanying HPK1 trans-regulation. J.Biol.Chem., 294, 2019
4R5G	Crystal structure of the DnaK C-terminus with the inhibitor PET-16 分子名称: Chaperone protein DnaK, triphenyl(phenylethynyl)phosphonium 著者 Leu, J.I, Zhang, P, Murphy, M.E, Marmorstein, R, George, D.L. 登録日 2014-08-21 公開日 2014-09-10 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (3.4501 Å) 主引用文献 Structural Basis for the Inhibition of HSP70 and DnaK Chaperones by Small-Molecule Targeting of a C-Terminal Allosteric Pocket. Acs Chem.Biol., 9, 2014
6NHK	Mortalin nucleotide binding domain in the ADP-bound state 分子名称: ADENOSINE-5'-DIPHOSPHATE, GLYCEROL, MAGNESIUM ION, ... 著者 Page, R.C, Moseng, M.A, Nix, J.C. 登録日 2018-12-23 公開日 2019-04-17 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.777 Å) 主引用文献 Biophysical Consequences of EVEN-PLUS Syndrome Mutations for the Function of Mortalin. J.Phys.Chem.B, 123, 2019
6NQ5	human (alpha met/beta hemichrome) hemoglobin with S-nitrosation at beta-Cys93 分子名称: FE (III) ION, Hemoglobin subunit alpha, Hemoglobin subunit beta, ... 著者 Yi, J. 登録日 2019-01-19 公開日 2020-01-22 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 human (alpha met/beta hemichrome) hemoglobin with S-nitrosation at beta-Cys93 To Be Published
6NRE	Monomeric Lipocalin Can F 6 分子名称: Lipocalin-Can f 6 allergen 著者 Clayton G, M, Kappler J, W, Chan, S. 登録日 2019-01-23 公開日 2019-09-25 実験手法 X-RAY DIFFRACTION (2.06 Å) 主引用文献 Structural characteristics of lipocalin allergens: Crystal structure of the immunogenic dog allergen Can f 6. Plos One, 14, 2019
4R2Q	Wilms Tumor Protein (WT1) zinc fingers in complex with formylated DNA 分子名称: 1,2-ETHANEDIOL, DNA (5'-D(*AP*GP*CP*GP*TP*GP*GP*GP*(5FC)P*GP*T)-3'), DNA (5'-D(*TP*AP*(5FC)P*GP*CP*CP*CP*AP*CP*GP*C)-3'), ... 著者 Hashimoto, H, Olanrewaju, Y.O, Zheng, Y, Wilson, G.G, Zhang, X, Cheng, X. 登録日 2014-08-12 公開日 2014-10-08 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.54 Å) 主引用文献 Wilms tumor protein recognizes 5-carboxylcytosine within a specific DNA sequence. Genes Dev., 28, 2014
6NG3	Crystal structure of human CD160 and HVEM complex 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CD160 antigen,Tumor necrosis factor receptor superfamily member 14, MAGNESIUM ION, ... 著者 Liu, W, Bonanno, J, Almo, S.C. 登録日 2018-12-21 公開日 2019-07-03 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.88 Å) 主引用文献 Structural Basis of CD160:HVEM Recognition. Structure, 27, 2019
4R5I	Crystal structure of the DnaK C-terminus with the substrate peptide NRLLLTG 分子名称: Chaperone protein DnaK, HSP70/DnaK Substrate Peptide: NRLLLTG, PHOSPHATE ION, ... 著者 Leu, J.I, Zhang, P, Murphy, M.E, Marmorstein, R, George, D.L. 登録日 2014-08-21 公開日 2014-09-10 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.9702 Å) 主引用文献 Structural Basis for the Inhibition of HSP70 and DnaK Chaperones by Small-Molecule Targeting of a C-Terminal Allosteric Pocket. Acs Chem.Biol., 9, 2014
6NKQ	The structure of bovine beta-lactoglobulin in novel crystals grown at pH 3.8 分子名称: Beta-lactoglobulin, CALCIUM ION 著者 McPherson, A. 登録日 2019-01-07 公開日 2019-01-23 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 The structure of bovine beta-lactoglobulin in crystals grown at pH 3.8 exhibiting novel threefold twinning. Acta Crystallogr.,Sect.F, 75, 2019
6NO8	PIM1 in complex with Cpd9 ((R)-5-amino-N-(3-(4-aminoazepan-1-yl)-1H-pyrazol-4-yl)-2-(2,6-difluorophenyl)thiazole-4-carboxamide) 分子名称: 5-amino-N-{5-[(4S)-4-aminoazepan-1-yl]-1-methyl-1H-pyrazol-4-yl}-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide, PHOSPHATE ION, Serine/threonine-protein kinase pim-1 著者 Murray, J.M, wang, X. 登録日 2019-01-15 公開日 2019-11-27 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.377 Å) 主引用文献 Optimization of Pan-Pim Kinase Activity and Oral Bioavailability Leading to Diaminopyrazole (GDC-0339) for the Treatment of Multiple Myeloma To be published
4RJ3	CDK2 with EGFR inhibitor compound 8 分子名称: 1-cyclopentyl-N-[2-(4-methoxypiperidin-1-yl)pyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-6-amine, ACETATE ION, Cyclin-dependent kinase 2 著者 Eigenbrot, C, Yin, J. 登録日 2014-10-08 公開日 2014-11-26 最終更新日 2015-01-14 実験手法 X-RAY DIFFRACTION (1.63 Å) 主引用文献 Discovery of Selective and Noncovalent Diaminopyrimidine-Based Inhibitors of Epidermal Growth Factor Receptor Containing the T790M Resistance Mutation. J.Med.Chem., 57, 2014
4RAT	EFFECTS OF TEMPERATURE ON PROTEIN STRUCTURE AND DYNAMICS: X-RAY CRYSTALLOGRAPHIC STUDIES OF THE PROTEIN RIBONUCLEASE-A AT NINE DIFFERENT TEMPERATURES FROM 98 TO 320 K 分子名称: RIBONUCLEASE A 著者 Tiltonjunior, R.F, Dewan, J.C, Petsko, G.A. 登録日 1991-08-13 公開日 1993-07-15 最終更新日 2024-06-05 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Effects of temperature on protein structure and dynamics: X-ray crystallographic studies of the protein ribonuclease-A at nine different temperatures from 98 to 320 K. Biochemistry, 31, 1992
4RKF	Drosophila melanogaster Rab3 bound to GMPPNP 分子名称: MAGNESIUM ION, PENTAETHYLENE GLYCOL, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, ... 著者 Lardong, J.A, Driller, J.H, Depner, H, Weise, C, Petzoldt, A, Wahl, M.C, Sigrist, S.J, Loll, B. 登録日 2014-10-13 公開日 2014-12-10 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Structures of Drosophila melanogaster Rab2 and Rab3 bound to GMPPNP. Acta Crystallogr F Struct Biol Commun, 71, 2015
6NSX	Yeast Hsh155 Ligand bound to Human Tat-SF1 Motif 分子名称: CHLORIDE ION, HIV Tat-specific factor 1, Hsh155 著者 Jenkins, J.L, Leach, J.R, Kielkopf, C.L. 登録日 2019-01-25 公開日 2019-06-05 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Cus2 enforces the first ATP-dependent step of splicing by binding to yeast SF3b1 through a UHM-ULM interaction. Rna, 25, 2019

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