PDB: 479 resultsInfo pagesStatus searchChemie searchBIRD

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6F82	AKR1B1 at 1.65 MGy radiation dose. Descriptor: Aldose reductase, CITRIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Castellvi, A, Juanhuix, J. Deposit date: 2017-12-12 Release date: 2019-03-13 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.03 Å) Cite: Efficacy of aldose reductase inhibitors is affected by oxidative stress induced under X-ray irradiation. Sci Rep, 9, 2019
6F7R	AKR1B1 at 0.03 MGy radiation dose. Descriptor: Aldose reductase, CITRIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Castellvi, A, Juanhuix, J. Deposit date: 2017-12-11 Release date: 2019-03-13 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (0.92 Å) Cite: Efficacy of aldose reductase inhibitors is affected by oxidative stress induced under X-ray irradiation. Sci Rep, 9, 2019
5LIW	Crystal structure of human AKR1B10 complexed with NADP+ and the inhibitor MK319 Descriptor: 1,2-ETHANEDIOL, Aldo-keto reductase family 1 member B10, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... Authors: Cousido-Siah, A, Ruiz, F.X, Mitschler, A, Fanfrlik, J, Kamlar, M, Vesely, J, Hobza, P, Podjarny, A. Deposit date: 2016-07-15 Release date: 2016-07-27 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.75 Å) Cite: IDD388 Polyhalogenated Derivatives as Probes for an Improved Structure-Based Selectivity of AKR1B10 Inhibitors. Acs Chem.Biol., 11, 2016
5LIX	Crystal structure of human AKR1B10 complexed with NADP+ and the inhibitor MK184 Descriptor: 1,2-ETHANEDIOL, Aldo-keto reductase family 1 member B10, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... Authors: Cousido-Siah, A, Ruiz, F.X, Mitschler, A, Fanfrlik, J, Kamlar, M, Vesely, J, Hobza, P, Podjarny, A. Deposit date: 2016-07-15 Release date: 2016-07-27 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.95 Å) Cite: IDD388 Polyhalogenated Derivatives as Probes for an Improved Structure-Based Selectivity of AKR1B10 Inhibitors. Acs Chem.Biol., 11, 2016
8IKU	Aldo-keto reductase KmAKR - W297H Descriptor: NADPH-dependent alpha-keto amide reductase Authors: Xu, S.Y, Zhou, L, Xu, Y, Wang, Y.J, Zheng, Y.G. Deposit date: 2023-03-01 Release date: 2024-03-06 Method: X-RAY DIFFRACTION (2.13 Å) Cite: Aldo-keto reductase KmAKR - W297H from Kluyveromyces marxianus To Be Published
5M2F	Crystal structure of human AKR1B10 complexed with NADP+ and the synthetic retinoid UVI2008 Descriptor: 1,2-ETHANEDIOL, 3-bromo-4-[(1E)-2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-en-1-yl]benzoic acid, Aldo-keto reductase family 1 member B10, ... Authors: Ruiz, F.X, Cousido-Siah, A, Mitschler, A, Porte, S, Alvarez, S, Dominguez, M, Alvarez, R, de Lera, A.R, Pares, X, Farres, J, Podjarny, A. Deposit date: 2016-10-12 Release date: 2017-02-15 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.503 Å) Cite: Structural basis for the inhibition of AKR1B10 by the C3 brominated TTNPB derivative UVI2008. Chem. Biol. Interact., 276, 2017
7BBZ	Crystal structure of apo aldo-keto reductase from Agrobacterium tumefaciens Descriptor: Aryl-alcohol dehydrogenase Authors: Snow, A, Sharma, M, Davies, G.J. Deposit date: 2020-12-18 Release date: 2022-01-12 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.77 Å) Cite: Oxidative desulfurization pathway for complete catabolism of sulfoquinovose by bacteria. Proc.Natl.Acad.Sci.USA, 119, 2022
7BC0	Crystal structure of aldo-keto reductase from Agrobacterium tumefaciens in a binary complex with NADPH Descriptor: Aryl-alcohol dehydrogenase, PHOSPHATE ION Authors: Snow, A, Sharma, M, Davies, G.J. Deposit date: 2020-12-18 Release date: 2022-01-12 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.83 Å) Cite: Oxidative desulfurization pathway for complete catabolism of sulfoquinovose by bacteria. Proc.Natl.Acad.Sci.USA, 119, 2022
7BBY	Crystal structure of aldo-keto reductase with C-terminal His tag from Agrobacterium tumefaciens Descriptor: Aryl-alcohol dehydrogenase, PHOSPHATE ION Authors: Snow, A, Sharma, M, Davies, G.J. Deposit date: 2020-12-18 Release date: 2022-01-12 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.83 Å) Cite: Oxidative desulfurization pathway for complete catabolism of sulfoquinovose by bacteria. Proc.Natl.Acad.Sci.USA, 119, 2022
7BC1	Crystal structure of aldo-keto reductase from Agrobacterium tumefaciens in a ternary complex with NADPH and glucose Descriptor: Aryl-alcohol dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, alpha-D-glucopyranose Authors: Snow, A, Sharma, M, Davies, G.J. Deposit date: 2020-12-18 Release date: 2022-01-12 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Oxidative desulfurization pathway for complete catabolism of sulfoquinovose by bacteria. Proc.Natl.Acad.Sci.USA, 119, 2022
7C7F	Crystal structures of AKR1C3 binary complex with NADP+ Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Aldo-keto reductase family 1 member C3, ... Authors: Irie, K, Toyooka, N, Endo, S. Deposit date: 2020-05-25 Release date: 2020-09-23 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Development of Novel AKR1C3 Inhibitors as New Potential Treatment for Castration-Resistant Prostate Cancer. J.Med.Chem., 63, 2020
7C7G	Crystal structures of AKR1C3 ternary complex with NADP+ and the chromene derivative 2j Descriptor: 2-azanylidene-N-(4-methylphenyl)-8-oxidanyl-chromene-3-carboxamide, Aldo-keto reductase family 1 member C3, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Irie, K, Toyooka, N, Endo, S. Deposit date: 2020-05-25 Release date: 2020-09-23 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.86 Å) Cite: Development of Novel AKR1C3 Inhibitors as New Potential Treatment for Castration-Resistant Prostate Cancer. J.Med.Chem., 63, 2020
1X97	Crystal structure of Aldose Reductase complexed with 2R4S (Stereoisomer of Fidarestat, 2S4S) Descriptor: (2R,4S)-2-AMINOFORMYL-6-FLUORO-SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-2',5'-DIONE, Aldose Reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: El-Kabbani, O, Darmanin, C, Oka, M, Schulze-Briese, C, Tomizaki, T, Hazemann, I, Mitschler, A, Podjarny, A. Deposit date: 2004-08-19 Release date: 2004-09-07 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (1.4 Å) Cite: High-Resolution Structures of Human Aldose Reductase Holoenzyme in Complex with Stereoisomers of the Potent Inhibitor Fidarestat: Stereospecific Interaction between the Enzyme and a Cyclic Imide Type Inhibitor J.Med.Chem., 47, 2004
1X96	Crystal structure of Aldose Reductase with citrates bound in the active site Descriptor: CITRIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, aldose reductase Authors: El-Kabbani, O, Darmanin, C, Oka, M, Schulze-Briese, C, Tomizaki, T, Hazemann, I, Mitschler, A, Podjarny, A. Deposit date: 2004-08-19 Release date: 2004-09-07 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (1.4 Å) Cite: High-Resolution Structures of Human Aldose Reductase Holoenzyme in Complex with Stereoisomers of the Potent Inhibitor Fidarestat: Stereospecific Interaction between the Enzyme and a Cyclic Imide Type Inhibitor J.Med.Chem., 47, 2004
1VP5	Crystal structure of 2,5-diketo-D-gluconic acid reductase (TM1009) from Thermotoga maritima at 2.40 A resolution Descriptor: 2,5-diketo-D-gluconic acid reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Joint Center for Structural Genomics (JCSG) Deposit date: 2004-10-13 Release date: 2004-10-26 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Crystal structure of 2,5-diketo-D-gluconic acid reductase (TM1009) from Thermotoga maritima at 2.40 A resolution To be published
1US0	Human Aldose Reductase in complex with NADP+ and the inhibitor IDD594 at 0.66 Angstrom Descriptor: ALDOSE REDUCTASE, CITRIC ACID, IDD594, ... Authors: Howard, E.I, Sanishvili, R, Cachau, R.E, Mitschler, A, Chevrier, B, Barth, P, Lamour, V, Van Zandt, M, Sibley, E, Bon, C, Moras, D, Schneider, T.R, Joachimiak, A, Podjarny, A. Deposit date: 2003-11-16 Release date: 2004-05-07 Last modified: 2024-05-08 Method: X-RAY DIFFRACTION (0.66 Å) Cite: Ultrahigh Resolution Drug Design I: Details of Interactions in Human Aldose Reductase-Inhibitor Complex at 0.66 A. Proteins, 55, 2004
1VBJ	The crystal structure of prostaglandin F synthase from Trypanosoma brucei Descriptor: CITRIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, prostaglandin F synthase Authors: Inoue, T. Deposit date: 2004-02-27 Release date: 2005-04-12 Last modified: 2023-12-27 Method: X-RAY DIFFRACTION (2.1 Å) Cite: The crystal structure of prostaglandin F synthase from Trypanosoma brucei TO BE PUBLISHED
7C7H	Crystal structures of AKR1C3 ternary complex with NADP+ and the chromene derivative 2l Descriptor: 2-azanylidene-N-(3-ethylphenyl)-8-oxidanyl-chromene-3-carboxamide, Aldo-keto reductase family 1 member C3, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Irie, K, Toyooka, N, Endo, S. Deposit date: 2020-05-25 Release date: 2020-09-23 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.86 Å) Cite: Development of Novel AKR1C3 Inhibitors as New Potential Treatment for Castration-Resistant Prostate Cancer. J.Med.Chem., 63, 2020
7EZL	Rice L-galactose dehydrogenase (holo form) Descriptor: L-galactose dehydrogenase, MAGNESIUM ION, NICOTINAMIDE-ADENINE-DINUCLEOTIDE Authors: Momma, M, Fujimoto, Z. Deposit date: 2021-06-01 Release date: 2021-06-23 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Crystal structure of rice L-galactose dehydrogenase To Be Published
7EZI	Rice L-galactose dehydrogenase (apo form) Descriptor: L-galactose dehydrogenase, MAGNESIUM ION Authors: Momma, M, Fujimoto, Z. Deposit date: 2021-06-01 Release date: 2021-06-23 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.2 Å) Cite: Crystal structure of rice L-galactose dehydrogenase To Be Published
1UR3	Crystal structure of the apo form of the E.coli ydhF protein Descriptor: HYPOTHETICAL OXIDOREDUCTASE YDHF, SULFATE ION Authors: Jeudy, S, Claverie, J.M, Abergel, C. Deposit date: 2003-10-24 Release date: 2003-12-04 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (2.57 Å) Cite: Crystal Structure of Ydhf the E.Coli Aldo-Keto Reductase Ydhf To be Published
1XF0	Crystal structure of human 17beta-hydroxysteroid dehydrogenase type 5 (AKR1C3) complexed with delta4-androstene-3,17-dione and NADP Descriptor: 4-ANDROSTENE-3-17-DIONE, ACETATE ION, Aldo-keto reductase family 1 member C3, ... Authors: Qiu, W, Zhou, M, Labrie, F, Lin, S.-X. Deposit date: 2004-09-13 Release date: 2004-10-26 Last modified: 2023-08-23 Method: X-RAY DIFFRACTION (2 Å) Cite: Crystal structures of the multispecific 17beta-hydroxysteroid dehydrogenase type 5: critical androgen regulation in human peripheral tissues Mol.Endocrinol., 18, 2004
1XGD	Apo R268A human aldose reductase Descriptor: Aldose reductase Authors: Brownlee, J.M, Bohren, K.M, Milne, A.C, Gabbay, K.H, Harrison, D.H.T. Deposit date: 2004-09-16 Release date: 2005-03-29 Last modified: 2023-08-23 Method: X-RAY DIFFRACTION (2.1 Å) Cite: The structure of Apo R268A human aldose reductase: Hinges and latches that control the kinetic mechanism Biochim.Biophys.Acta, 1748, 2005
1X98	Crystal structure of Aldose Reductase complexed with 2S4R (Stereoisomer of Fidarestat, 2S4S) Descriptor: (2S,4R)-2-AMINOFORMYL-6-FLUORO-SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-2',5'-DIONE, Aldose Reductase, CITRIC ACID, ... Authors: El-Kabbani, O, Darmanin, C, Oka, M, Schulze-Briese, C, Tomizaki, T, Hazemann, I, Mitschler, A, Podjarny, A. Deposit date: 2004-08-19 Release date: 2004-09-07 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (1.3 Å) Cite: High-Resolution Structures of Human Aldose Reductase Holoenzyme in Complex with Stereoisomers of the Potent Inhibitor Fidarestat: Stereospecific Interaction between the Enzyme and a Cyclic Imide Type Inhibitor J.Med.Chem., 47, 2004
1XJB	Crystal structure of human type 3 3alpha-hydroxysteroid dehydrogenase in complex with NADP(H), citrate and acetate molecules Descriptor: 1,2-ETHANEDIOL, ACETATE ION, Aldo-keto reductase family 1 member C2, ... Authors: Couture, J.-F, Pereira de Jesus-Tran, K, Roy, A.-M, Legrand, P, Cantin, L, Cote, P.-L, Luu-The, V, Labrie, F, Breton, R. Deposit date: 2004-09-23 Release date: 2005-06-21 Last modified: 2023-08-23 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Comparison of crystal structures of human type 3 3alpha-hydroxysteroid dehydrogenase reveals an "induced-fit" mechanism and a conserved basic motif involved in the binding of androgen Protein Sci., 14, 2005

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