PDB: 82203 件ウェブページステータス検索Chemie searchBIRD

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2MJY	Solution structure of synthetic Mamba-1 peptide 分子名称: Mambalgin-1 著者 He, Y, Wu, F, Tian, C. 登録日 2014-01-21 公開日 2015-01-28 最終更新日 2023-06-14 実験手法 SOLUTION NMR 主引用文献 One-pot hydrazide-based native chemical ligation for efficient chemical synthesis and structure determination of toxin Mambalgin-1 Chem.Commun.(Camb.), 50, 2014
1MVY	Amylosucrase mutant E328Q co-crystallized with maltoheptaose. 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, ... 著者 Skov, L.K, Mirza, O, Sprogoe, D, Dar, I, Remaud-Simeon, M, Albenne, C, Monsan, P, Gajhede, M. 登録日 2002-09-27 公開日 2002-12-18 最終更新日 2024-05-29 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Oligosaccharide and Sucrose Complexes of Amylosucrase. STRUCTURAL IMPLICATIONS FOR THE POLYMERASE ACTIVITY J.BIOL.CHEM., 277, 2002
8C11	BRD4 in complex with 2-(2-(4-(3,5-dimethylisoxazol-4-yl)-1H-pyrazol-1-yl)acetamido)-N-ethylpropanamide 分子名称: (2~{S})-2-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazol-1-yl]ethanoylamino]-~{N}-ethyl-propanamide, Bromodomain-containing protein 4 著者 Martin, M.P, Noble, M.E.N. 登録日 2022-12-19 公開日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 BRD4 complex with compound 22 To Be Published
1MW1	Amylosucrase soaked with 14mM sucrose. 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, amylosucrase, beta-D-fructofuranose-(2-1)-alpha-D-glucopyranose 著者 Skov, L.K, Mirza, O, Sprogoe, D, Dar, I, Remaud-Simeon, M, Albenne, C, Monsan, P, Gajhede, M. 登録日 2002-09-27 公開日 2002-12-18 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Oligosaccharide and Sucrose Complexes of Amylosucrase. STRUCTURAL IMPLICATIONS FOR THE POLYMERASE ACTIVITY J.BIOL.CHEM., 277, 2002
5ISX	Structure of the holo PCP-E didomain of the gramicidin S synthetase A 分子名称: 4'-PHOSPHOPANTETHEINE, GLYCEROL, Gramicidin S synthase 1 著者 Chen, W.-H, Li, K, Bruner, S.D. 登録日 2016-03-15 公開日 2016-06-29 最終更新日 2019-11-27 実験手法 X-RAY DIFFRACTION (2.335 Å) 主引用文献 Interdomain and Intermodule Organization in Epimerization Domain Containing Nonribosomal Peptide Synthetases. Acs Chem.Biol., 11, 2016
8CNZ	mmLarE-[4Fe-4S] phased by Fe-SAD 分子名称: CHLORIDE ION, IODIDE ION, IRON/SULFUR CLUSTER, ... 著者 Pecqueur, L, Zecchin, P, Golinelli-Pimpaneau, B. 登録日 2023-02-24 公開日 2024-01-31 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (3.6 Å) 主引用文献 Structure-based insights into the mechanism of [4Fe-4S]-dependent sulfur insertase LarE. Protein Sci., 33, 2024
8CP4	[4Fe-4S] cluster containing LarE in complex with AMP 分子名称: ADENOSINE MONOPHOSPHATE, CHLORIDE ION, IRON/SULFUR CLUSTER, ... 著者 Zecchin, P, Pecqueur, L, Golinelli-Pimpaneau, B. 登録日 2023-03-01 公開日 2024-01-31 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (3.19 Å) 主引用文献 Structure-based insights into the mechanism of [4Fe-4S]-dependent sulfur insertase LarE. Protein Sci., 33, 2024
8CWJ	Fab arms of antibodies 4C12-B12 and CR3022 bound to pangolin receptor binding domain (pRBD) 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, ... 著者 Langley, D.B, Christ, D. 登録日 2022-05-19 公開日 2023-05-24 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.449 Å) 主引用文献 Neutralization of CoV-2 omicron lineages by affinity-matured class 5 antibodies To Be Published
6N96	Methylmalonyl-CoA decarboxylase in complex with 2-sulfonate-propionyl-oxa(dethia)-CoA 分子名称: (2~{R})-1-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethoxy]-1-oxidanylidene-propane-2-sulfonic acid, (2~{S})-1-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethoxy]-1-oxidanylidene-propane-2-sulfonic acid, IMIDAZOLE, ... 著者 Stunkard, L.M, Dixon, A.D, Huth, T.J, Lohman, J.R. 登録日 2018-11-30 公開日 2019-04-10 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Sulfonate/Nitro Bearing Methylmalonyl-Thioester Isosteres Applied to Methylmalonyl-CoA Decarboxylase Structure-Function Studies. J. Am. Chem. Soc., 141, 2019
3K9X	X-ray crystal structure of human fxa in complex with (S)-N-((2-METHYLBENZOFURAN-5-YLAMINO)(2-OXO-1-(2-OXO-2- (PYRROLIDIN-1-YL)ETHYL)AZEPAN-3- YLAMINO)METHYLENE)NICOTINAMIDE 分子名称: CALCIUM ION, GLYCEROL, N-{N'-(2-methyl-1-benzofuran-5-yl)-N-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]carbamimidoyl}pyridine-3-carboxamide, ... 著者 Klei, H.E, Kish, K, Ghosh, K, Rushith, A. 登録日 2009-10-16 公開日 2009-12-15 最終更新日 2017-11-01 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Aroylguanidine-based factor Xa inhibitors: the discovery of BMS-344577 Bioorg.Med.Chem.Lett., 19, 2009
4D38	Structure of bovine endothelial nitric oxide synthase heme domain in complex with (1R,2R)-2-(3-fluorobenzyl)-N-{2-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}cyclopropanamine 分子名称: (1R,2R)-2-(3-fluorobenzyl)-N-{2-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}cyclopropanamine, 5,6,7,8-TETRAHYDROBIOPTERIN, ACETATE ION, ... 著者 Li, H, Poulos, T.L. 登録日 2014-10-20 公開日 2014-12-24 最終更新日 2015-03-04 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Novel 2,4-Disubstituted Pyrimidines as Potent, Selective, and Cell-Permeable Inhibitors of Neuronal Nitric Oxide Synthase. J.Med.Chem., 58, 2015
1RNY	RIBONUCLEASE A CRYSTALLIZED FROM 3M CESIUM CHLORIDE, 30% AMMONIUM SULFATE 分子名称: CESIUM ION, CHLORIDE ION, RIBONUCLEASE A 著者 Fedorov, A.A, Joseph-Mccarthy, D, Fedorov, L, Sirakova, D, Graf, I, Almo, S.C. 登録日 1996-04-23 公開日 1996-11-08 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Ionic interactions in crystalline bovine pancreatic ribonuclease A. Biochemistry, 35, 1996
3HPT	Crystal structure of human FxA in complex with (S)-2-cyano-1-(2-methylbenzofuran-5-yl)-3-(2-oxo-1-(2-oxo-2-(pyrrolidin-1-yl)ethyl)azepan-3-yl)guanidine 分子名称: 1-cyano-2-(2-methyl-1-benzofuran-5-yl)-3-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]guanidine, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ACETATE ION, ... 著者 Klei, H.E, Ghosh, K, Rushith, A, Kish, K. 登録日 2009-06-04 公開日 2009-11-17 最終更新日 2017-11-01 実験手法 X-RAY DIFFRACTION (2.19 Å) 主引用文献 Cyanoguanidine-based lactam derivatives as a novel class of orally bioavailable factor Xa inhibitors. Bioorg.Med.Chem.Lett., 19, 2009
1QKS	CYTOCHROME CD1 NITRITE REDUCTASE, OXIDISED FORM 分子名称: CYTOCHROME CD1 NITRITE REDUCTASE, GLYCEROL, HEME C, ... 著者 Fulop, V. 登録日 1999-08-05 公開日 1999-08-18 最終更新日 2019-10-09 実験手法 X-RAY DIFFRACTION (1.28 Å) 主引用文献 The anatomy of a bifunctional enzyme: structural basis for reduction of oxygen to water and synthesis of nitric oxide by cytochrome cd1. Cell(Cambridge,Mass.), 81, 1995
3LKT	Tyrosine 447 of Protocatechuate 3,4-Dioxygenase Controls Efficient Progress Through Catalysis 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, BETA-MERCAPTOETHANOL, CHLORIDE ION, ... 著者 Lipscomb, J.D, Purpero, V.M. 登録日 2010-01-27 公開日 2011-02-23 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Tyrosine 447 of Protocatechuate 3,4-Dioxygenase Controls Efficient Progress Through Catalysis To be Published
3ENS	Crystal structure of human FXA in complex with methyl (2Z)-3-[(3-chloro-1H-indol-7-yl)amino]-2-cyano-3-{[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]amino}acrylate 分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ACETATE ION, Activated factor Xa heavy chain, ... 著者 Klei, H.E. 登録日 2008-09-25 公開日 2008-12-30 最終更新日 2017-10-25 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Design, Structure-Activity Relationships, X-ray Crystal Structure, and Energetic Contributions of a Critical P1 Pharmacophore: 3-Chloroindole-7-yl-Based Factor Xa Inhibitors. J.Med.Chem., 51, 2008
3LSZ	Crystal structure of glutathione s-transferase from Rhodobacter sphaeroides 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, GLUTATHIONE, GLYCEROL, ... 著者 Eswaramoorthy, S, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC) 登録日 2010-02-14 公開日 2010-03-23 最終更新日 2021-02-10 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Crystal structure of glutathione s-transferase from Rhodobacter sphaeroides To be Published
3LXV	Tyrosine 447 of Protocatechuate 3,4-Dioxygenase Controls Efficient Progress Through Catalysis 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 4-NITROCATECHOL, BETA-MERCAPTOETHANOL, ... 著者 Purpero, V.M, Lipscomb, J.D. 登録日 2010-02-25 公開日 2011-03-09 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Tyrosine 447 of Protocatechuate 3,4-Dioxygenase Controls Efficient Progress Through Catalysis To be Published, 2010
7D23	Crystal structure of Ixodes scapularis glutaminyl cyclase with one K ion bound to the active site 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Glutaminyl-peptide cyclotransferase, POTASSIUM ION 著者 Huang, K.-F, Huang, J.-S, Wu, M.-L, Hsieh, W.-L, Wang, A.H.-J. 登録日 2020-09-15 公開日 2021-04-14 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 A Unique Carboxylic-Acid Hydrogen-Bond Network (CAHBN) Confers Glutaminyl Cyclase Activity on M28 Family Enzymes. J.Mol.Biol., 433, 2021
7SIU	Crystal structure of HPK1 (MAP4K1) complex with inhibitor A-745 分子名称: 6-[(5R)-5-benzamidocyclohex-1-en-1-yl]-3-[(1-methyl-1H-pyrazol-4-yl)amino]pyrazine-2-carboxamide, Mitogen-activated protein kinase kinase kinase kinase 1, SULFATE ION 著者 Longenecker, K.L, Korepanova, A, Qiu, W. 登録日 2021-10-14 公開日 2022-03-02 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.786 Å) 主引用文献 The HPK1 Inhibitor A-745 Verifies the Potential of Modulating T Cell Kinase Signaling for Immunotherapy. Acs Chem.Biol., 17, 2022
3M0Z	Crystal structure of putative aldolase from Klebsiella pneumoniae. 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, GLYCEROL, SULFATE ION, ... 著者 Chang, C, Rakowski, E, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) 登録日 2010-03-03 公開日 2010-03-31 最終更新日 2017-11-08 実験手法 X-RAY DIFFRACTION (1.2 Å) 主引用文献 Crystal structure of putative aldolase from Klebsiella pneumoniae. To be Published
7TGR	Structure of SARS-CoV-2 main protease in complex with GC376 分子名称: (1R,2S)-2-({N-[(benzyloxy)carbonyl]-L-leucyl}amino)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid, (1S,2S)-2-({N-[(benzyloxy)carbonyl]-L-leucyl}amino)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid, 1,2-ETHANEDIOL, ... 著者 Esler, M.A, Shi, K, Aihara, H, Harris, R.S. 登録日 2022-01-09 公開日 2022-05-04 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.68 Å) 主引用文献 Gain-of-Signal Assays for Probing Inhibition of SARS-CoV-2 M pro /3CL pro in Living Cells. Mbio, 13, 2022
4WFS	Crystal Structure of tRNA-dihydrouridine(20) synthase catalytic domain 分子名称: CHLORIDE ION, FLAVIN MONONUCLEOTIDE, SULFATE ION, ... 著者 Bou-Nader, C, Pecqueur, L, Kamah, A, Bregeon, D, Golinelli-Pimpaneau, B, Guimaraes, B.G, Fontecave, M, Hamdane, D. 登録日 2014-09-17 公開日 2015-10-07 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.68 Å) 主引用文献 An extended dsRBD is required for post-transcriptional modification in human tRNAs. Nucleic Acids Res., 43, 2015
3EFP	Crystal structure of the Escherichia coli twin arginine leader peptide binding protein DmsD in a monomeric form 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CHLORIDE ION, GLYCEROL, ... 著者 Stevens, C.M, Paetzel, M. 登録日 2008-09-09 公開日 2009-04-07 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2.01 Å) 主引用文献 Structural analysis of a monomeric form of the twin-arginine leader peptide binding chaperone Escherichia coli DmsD. J.Mol.Biol., 389, 2009
3EQA	Catalytic domain of glucoamylase from aspergillus niger complexed with tris and glycerol 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, GLYCEROL, Glucoamylase, ... 著者 Lee, J, Paetzel, M. 登録日 2008-09-30 公開日 2009-10-13 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structure of the catalytic domain of glucoamylase from Aspergillus niger. Acta Crystallogr.,Sect.F, 67, 2011

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