PDB: 35415 件ウェブページステータス検索Chemie searchBIRD

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5TPR	Desmethyl-4-deoxygadusol synthase from Anabaena variabilis (Ava_3858) with NAD+ and Zn2+ bound 分子名称: 3-dehydroquinate synthase, DI(HYDROXYETHYL)ETHER, GLYCEROL, ... 著者 Kean, K.M, Karplus, P.A. 登録日 2016-10-21 公開日 2017-02-22 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Evolution and Distribution of C7-Cyclitol Synthases in Prokaryotes and Eukaryotes. ACS Chem. Biol., 12, 2017
6CR2	Crystal structure of sterol 14-alpha demethylase (CYP51B) from Aspergillus fumigatus in complex with the VNI derivative N-(1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl)-4-(5-(2-fluoro-4-(2,2,2-trifluoroethoxy)phenyl)-1,3,4-oxadiazol-2-yl)benzamide 分子名称: 14-alpha sterol demethylase Cyp51B, N-[(1R)-1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl]-4-{5-[2-fluoro-4-(2,2,2-trifluoroethoxy)phenyl]-1,3,4-oxadiazol-2-yl}benzamide, PROTOPORPHYRIN IX CONTAINING FE 著者 Friggeri, L, Hargrove, T.Y, Wawrzak, Z, Lepesheva, G.I. 登録日 2018-03-16 公開日 2018-06-27 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.38 Å) 主引用文献 Sterol 14 alpha-Demethylase Structure-Based Design of VNI (( R)- N-(1-(2,4-Dichlorophenyl)-2-(1 H-imidazol-1-yl)ethyl)-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide)) Derivatives To Target Fungal Infections: Synthesis, Biological Evaluation, and Crystallographic Analysis. J. Med. Chem., 61, 2018
1LF4	STRUCTURE OF PLASMEPSIN II 分子名称: Plasmepsin 2 著者 Asojo, O.A, Gulnik, S.V, Afonina, E, Yu, B, Ellman, J.A, Haque, T.S, Silva, A.M. 登録日 2002-04-10 公開日 2002-10-10 最終更新日 2023-08-16 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Novel uncomplexed and complexed structures of plasmepsin II, an aspartic protease from Plasmodium falciparum. J.Mol.Biol., 327, 2003
5TQP	LIPOXYGENASE-1 (SOYBEAN) I553G MUTANT AT 300K 分子名称: FE (III) ION, Seed linoleate 13S-lipoxygenase-1 著者 Poss, E.M, Fraser, J.S. 登録日 2016-10-24 公開日 2017-11-01 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Hydrogen-Deuterium Exchange of Lipoxygenase Uncovers a Relationship between Distal, Solvent Exposed Protein Motions and the Thermal Activation Barrier for Catalytic Proton-Coupled Electron Tunneling. ACS Cent Sci, 3, 2017
8ENE	Aldehyde dehydrogenase 1 family member A1 from human liver 分子名称: NICOTINAMIDE-ADENINE-DINUCLEOTIDE, Retinal dehydrogenase 1 著者 Zhang, Z. 登録日 2022-09-29 公開日 2023-05-03 最終更新日 2023-11-15 実験手法 ELECTRON MICROSCOPY (2.64 Å) 主引用文献 High-resolution structural-omics of human liver enzymes. Cell Rep, 42, 2023
5UL5	Crystal structure of RPE65 in complex with MB-004 and palmitate 分子名称: (1R)-3-amino-1-{3-[(2-propylpentyl)oxy]phenyl}propan-1-ol, 1-(2-METHOXY-ETHOXY)-2-{2-[2-(2-METHOXY-ETHOXY]-ETHOXY}-ETHANE, FE (II) ION, ... 著者 Kiser, P.D, Palczewski, K. 登録日 2017-01-24 公開日 2017-05-17 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Rational Tuning of Visual Cycle Modulator Pharmacodynamics. J. Pharmacol. Exp. Ther., 362, 2017
5US6	Structure of Dihydrodipicolinate Reductase from Vibrio vulnificus Bound to NADH and 2,6 Pyridine Dicarboxylic Acid with Intact Polyhistidine Tag 分子名称: 4-hydroxy-tetrahydrodipicolinate reductase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, PYRIDINE-2,6-DICARBOXYLIC ACID, ... 著者 Mank, N.M, Arnette, A.K, Chruszcz, M. 登録日 2017-02-13 公開日 2018-02-21 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (2.61 Å) 主引用文献 Comparative structural and mechanistic studies of 4-hydroxy-tetrahydrodipicolinate reductases from Mycobacterium tuberculosis and Vibrio vulnificus. Biochim Biophys Acta Gen Subj, 1865, 2021
8JNO	Crystal structure of cytochrome P450 IkaD from Streptomyces sp. ZJ306, in complex with the substrate 10-epi-deOH-HSAF 分子名称: (1Z,3E,5S,7S,8R,9S,10S,11R,13R,15R,16S,18Z,25S)-11-ethyl-2,7-dihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.09,13.08,15.05,16]octacosa-1(2),3,18-triene-20,27,28-trione, Cytochrome P450, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Zhang, Y.L, Zhang, L.P, Zhang, C.S. 登録日 2023-06-06 公開日 2023-11-22 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 A Mechanistic Understanding of the Distinct Regio- and Chemoselectivity of Multifunctional P450s by Structural Comparison of IkaD and CftA Complexed with Common Substrates. Angew.Chem.Int.Ed.Engl., 62, 2023
6CYA	Rotavirus SA11 NSP2 S313A mutant 分子名称: CHLORIDE ION, GLYCEROL, Non-structural protein 2 著者 Anish, R, Hu, L, Prasad, B.V.V. 登録日 2018-04-05 公開日 2018-12-05 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Phosphorylation cascade regulates the formation and maturation of rotaviral replication factories. Proc. Natl. Acad. Sci. U.S.A., 115, 2018
5MI7	BtGH84 mutant with covalent modification by MA4 in complex with PUGNAc 分子名称: CALCIUM ION, O-(2-ACETAMIDO-2-DEOXY D-GLUCOPYRANOSYLIDENE) AMINO-N-PHENYLCARBAMATE, O-GlcNAcase BT_4395, ... 著者 Darby, J.F, Davies, G.J, Hubbard, R.E. 登録日 2016-11-27 公開日 2017-11-01 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Increase of enzyme activity through specific covalent modification with fragments. Chem Sci, 8, 2017
8J3M	Structure of GH1 Br2 beta-glucosidase from bovine rumen metagenome 分子名称: Beta-glucosidase, GLYCEROL, SULFATE ION 著者 Kaenying, W, Kongsaeree, P.T, Tagami, T. 登録日 2023-04-17 公開日 2023-11-22 最終更新日 2024-01-03 実験手法 X-RAY DIFFRACTION (1.999 Å) 主引用文献 Structural and mutational analysis of glycoside hydrolase family 1 Br2 beta-glucosidase derived from bovine rumen metagenome. Heliyon, 9, 2023
8J5L	Structure of GH1 Br2 beta-glucosidase E163Q mutant from bovine rumen metagenome 分子名称: Beta-glucosidase, GLYCEROL, SULFATE ION 著者 Kaenying, W, Kongsaeree, P.T, Tagami, T. 登録日 2023-04-23 公開日 2023-11-22 最終更新日 2024-01-03 実験手法 X-RAY DIFFRACTION (2.095 Å) 主引用文献 Structural and mutational analysis of glycoside hydrolase family 1 Br2 beta-glucosidase derived from bovine rumen metagenome. Heliyon, 9, 2023
4TOQ	Crystal structure of class III chitinase from pomegranate provides the insight into its metal storage capacity 分子名称: CHLORIDE ION, Class III chitinase, MAGNESIUM ION 著者 Masuda, T, Zhao, G, Mikami, B. 登録日 2014-06-06 公開日 2014-09-10 最終更新日 2020-01-29 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Crystal structure of class III chitinase from pomegranate provides the insight into its metal storage capacity. Biosci.Biotechnol.Biochem., 79, 2015
8J5M	Structure of GH1 Br2 beta-glucosidase E350G mutant from bovine rumen metagenome 分子名称: ACETATE ION, Beta-glucosidase, SULFATE ION 著者 Kaenying, W, Kongsaeree, P.T, Tagami, T. 登録日 2023-04-23 公開日 2023-11-22 最終更新日 2024-01-03 実験手法 X-RAY DIFFRACTION (1.621 Å) 主引用文献 Structural and mutational analysis of glycoside hydrolase family 1 Br2 beta-glucosidase derived from bovine rumen metagenome. Heliyon, 9, 2023
5UVB	The crystal structure of 4-cyclopropylbenzoate-bound CYP199A4 分子名称: 4-cyclopropylbenzoic acid, CHLORIDE ION, Cytochrome P450, ... 著者 Coleman, T, Bruning, J.B, Bell, S.G. 登録日 2017-02-20 公開日 2018-02-28 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.54 Å) 主引用文献 The crystal structure of 4-cyclopropylbenzoate-bound CYP199A4 To Be Published
5DEX	Crystal structure of GluN1/GluN2A NMDA receptor agonist binding domains with glycine and antagonist, phenyl-ACEPC 分子名称: 5-[(2R)-2-amino-2-carboxyethyl]-1-phenyl-1H-pyrazole-3-carboxylic acid, GLYCINE, Glutamate receptor ionotropic, ... 著者 Mou, T.-C, Conti, P, Pinto, A, Tamborini, L, Sprang, S.R, Hansen, K.B. 登録日 2015-08-26 公開日 2016-09-14 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Structural basis of subunit selectivity for competitive NMDA receptor antagonists with preference for GluN2A over GluN2B subunits. Proc. Natl. Acad. Sci. U.S.A., 2017
4H6H	Crystal Structure of Staphylococcal Complement Inhibitor SCIN-B(4-85) 分子名称: Fibrinogen-binding protein 著者 Garcia, B.L, Geisbrecht, B.V. 登録日 2012-09-19 公開日 2012-12-19 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.5024 Å) 主引用文献 A Structurally Dynamic N-terminal Helix Is a Key Functional Determinant in Staphylococcal Complement Inhibitor (SCIN) Proteins. J.Biol.Chem., 288, 2013
1UJV	Solution structure of the second PDZ domain of human membrane associated guanylate kinase inverted-2 (MAGI-2) 分子名称: MEMBRANE ASSOCIATED GUANYLATE KINASE INVERTED-2 (MAGI-2) 著者 Nameki, N, Koshiba, S, Kigawa, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI) 登録日 2003-08-11 公開日 2004-02-11 最終更新日 2023-12-27 実験手法 SOLUTION NMR 主引用文献 Solution structure of the second PDZ domain of human membrane associated guanylate kinase inverted-2 (MAGI-2) To be Published
8JB1	Crystal structure of glyceraldehyde-3-phosphate dehydrogenase from Corynebacterium glutamicum ATCC13032 in complex with NADP 分子名称: GLYCEROL, Glyceraldehyde-3-phosphate dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 著者 Son, H.F, Kim, K.J. 登録日 2023-05-07 公開日 2023-12-06 実験手法 X-RAY DIFFRACTION (2.44 Å) 主引用文献 Structure-based functional analysis of a novel NADPH-producing glyceraldehyde-3-phosphate dehydrogenase from Corynebacterium glutamicum. Int.J.Biol.Macromol., 255, 2023
5M7U	Structure of human O-GlcNAc hydrolase with new iminocyclitol type inhibitor 分子名称: 2-[(2~{R},3~{S},4~{R},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)-1-[3-[3-(trifluoromethyl)phenyl]propyl]pyrrolidin-2-yl]-~{N}-methyl-ethanamide, Protein O-GlcNAcase 著者 Roth, C, Chan, S, Offen, W.A, Hemsworth, G.R, Willems, L.I, King, D, Varghese, V, Britton, R, Vocadlo, D.J, Davies, G.J. 登録日 2016-10-28 公開日 2017-03-29 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structural and functional insight into human O-GlcNAcase. Nat. Chem. Biol., 13, 2017
8CZP	2.25 angstrom resolution crystal structure of as-isolated KatG from Mycobacterium tuberculosis with an MYW cofactor 分子名称: ACETATE ION, Catalase-peroxidase, PROTOPORPHYRIN IX CONTAINING FE 著者 Li, J, Liu, A. 登録日 2022-05-25 公開日 2023-12-13 実験手法 X-RAY DIFFRACTION (2.25 Å) 主引用文献 2.25 angstrom resolution crystal structure of as-isolated KatG from Mycobacterium tuberculosis with an MYW cofactor To Be Published
4ROS	Crystal structure of Methylobacterium extorquens malate dehydrogenase complexed with oxaloacetate and adenosine-5-diphosphoribose 分子名称: ADENOSINE-5-DIPHOSPHORIBOSE, CALCIUM ION, Malate dehydrogenase, ... 著者 Gonzalez, J.M, Marti-Arbona, R, Unkefer, C.J. 登録日 2014-10-28 公開日 2014-12-17 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Crystal structure of Methylobacterium extorquens malate dehydrogenase complexed with oxaloacetate and adenosine-5-diphosphoribose To be Published
5MI4	BtGH84 mutant with covalent modification by MA3 分子名称: 1,2-ETHANEDIOL, CALCIUM ION, O-GlcNAcase BT_4395, ... 著者 Darby, J.F, Davies, G.J, Hubbard, R.E. 登録日 2016-11-27 公開日 2017-11-01 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Increase of enzyme activity through specific covalent modification with fragments. Chem Sci, 8, 2017
4HXM	Brd4 Bromodomain 1 complex with N-{3-(2-OXO-2,3-DIHYDRO-1,3-THIAZOL-4-YL)-5-[(THIOPHEN-2-YLSULFONYL)AMINO]PHENYL}BUTANAMIDE inhibitor 分子名称: Bromodomain-containing protein 4, N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(thiophen-2-ylsulfonyl)amino]phenyl}butanamide 著者 Chen, T.T, Cao, D.Y, Chen, W.Y, Xiong, B, Shen, J.K, Xu, Y.C. 登録日 2012-11-12 公開日 2013-04-03 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain. J.Med.Chem., 56, 2013
4RKA	Crystal structure of human dihydroorotate dehydrogenase (DHODH) with DH03A347 分子名称: 2-{[5-(naphthalen-1-ylmethyl)-4-oxo-4H-1lambda~4~,3-thiazol-2-yl]amino}benzoic acid, Dihydroorotate dehydrogenase (quinone), mitochondrial, ... 著者 Zhu, L, Ren, X, Zhu, J, Li, H. 登録日 2014-10-12 公開日 2015-11-11 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.71 Å) 主引用文献 Crystal structure of human dihydroorotate dehydrogenase (DHODH) with DH03A347 TO BE PUBLISHED

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