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6NJ7	11-BETA DEHYDROGENASE ISOZYME 1 IN COMPLEX WITH COLLETOIC ACID Descriptor: (1S,4S,5S,9S)-9-hydroxy-8-methyl-4-(propan-2-yl)spiro[4.5]dec-7-ene-1-carboxylic acid, Corticosteroid 11-beta-dehydrogenase isozyme 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Miller, D.J, Rivas, F. Deposit date: 2019-01-02 Release date: 2019-07-24 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Mechanistic Insight on the Mode of Action of Colletoic Acid. J.Med.Chem., 62, 2019
2BD0	Chlorobium tepidum Sepiapterin Reductase complexed with NADP and Sepiapterin Descriptor: BIOPTERIN, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, sepiapterin reductase Authors: Supangat, S, Seo, K.H, Choi, Y.K, Park, Y.S, Lee, K.H. Deposit date: 2005-10-19 Release date: 2005-11-29 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Structure of Chlorobium tepidum sepiapterin reductase complex reveals the novel substrate binding mode for stereospecific production of L-threo-tetrahydrobiopterin J.Biol.Chem., 281, 2006
9JDQ	Crystal structure of reductase EA Descriptor: Oxidoreductase Authors: Tang, J, Liuqing, C. Deposit date: 2024-09-01 Release date: 2024-09-18 Method: X-RAY DIFFRACTION (1.71 Å) Cite: crystal structure of reductase LSADH To Be Published
5VML	Crystal Structure of Acetoacetyl-CoA Reductase from Burkholderia Pseudomallei 1710b with bound NADP Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Acetoacetyl-CoA reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2017-04-27 Release date: 2017-05-24 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Crystal Structure of Acetoacetyl-CoA Reductase from Burkholderia Pseudomallei 1710b with bound NADP to be published
2RHR	P94L actinorhodin ketordeuctase mutant, with NADPH and Inhibitor Emodin Descriptor: 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE, Actinorhodin Polyketide Ketoreductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Korman, T.P, Tsai, S.-C. Deposit date: 2007-10-09 Release date: 2008-08-19 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Inhibition kinetics and emodin cocrystal structure of a type II polyketide ketoreductase Biochemistry, 47, 2008
1SO8	Abeta-bound human ABAD structure [also known as 3-hydroxyacyl-CoA dehydrogenase type II (Type II HADH), Endoplasmic reticulum-associated amyloid beta-peptide binding protein (ERAB)] Descriptor: 3-hydroxyacyl-CoA dehydrogenase type II, CHLORIDE ION, SODIUM ION Authors: Lustbader, J.W, Cirilli, M, Wu, H. Deposit date: 2004-03-13 Release date: 2004-05-11 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (2.3 Å) Cite: ABAD directly links Abeta to mitochondrial toxicity in Alzheimer's disease. Science, 304, 2004
4WEO	Crystal Structure of a Putative acetoin(Diacetyl) Reductase Burkholderia cenocepacia Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, GLYCEROL, ... Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2014-09-10 Release date: 2014-09-24 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Crystal Structure of a Putative acetoin(Diacetyl) Reductase Burkholderia cenocepacia to be published
7ULH	Crystal Structure of a Short chain dehydrogenase from Mycobacterium avium 104 Descriptor: Short chain dehydrogenase Authors: Seattle Structural Genomics Center for Infectious Disease, Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2022-04-04 Release date: 2022-04-13 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Crystal Structure of Crystal Structure of a Short chain dehydrogenase from Mycobacterium avium 104 to be published
8X89	Crystal Structure of Streptococcus pneumoniae fabG Descriptor: 3-oxoacyl-[acyl-carrier-protein] reductase Authors: Xu, K.M. Deposit date: 2023-11-27 Release date: 2024-10-16 Last modified: 2024-10-30 Method: X-RAY DIFFRACTION (1.99 Å) Cite: Structure features of Streptococcus pneumoniae FabG and virtual screening of allosteric inhibitors. Front Mol Biosci, 11, 2024
7JK9	Helical filaments of plant light-dependent protochlorophyllide oxidoreductase (LPOR) bound to NADPH, Pchlide, and membrane Descriptor: 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Protochlorophyllide, ... Authors: Nguyen, H.C, Gabruk, M, Frost, A. Deposit date: 2020-07-28 Release date: 2021-03-17 Last modified: 2024-05-15 Method: ELECTRON MICROSCOPY (3.1 Å) Cite: Photocatalytic LPOR forms helical lattices that shape membranes for chlorophyll synthesis. Nat.Plants, 7, 2021
6YC8	Crystal structure of KRED1-Pglu enzyme Descriptor: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ACETATE ION, ... Authors: Di Pisa, F. Deposit date: 2020-03-18 Release date: 2021-02-10 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.77 Å) Cite: Structural insights into the desymmetrization of bulky 1,2-dicarbonyls through enzymatic monoreduction. Bioorg.Chem., 108, 2021
3UVE	Crystal structure of Carveol dehydrogenase ((+)-trans-carveol dehydrogenase) from Mycobacterium avium Descriptor: 1,2-ETHANEDIOL, Carveol dehydrogenase ((+)-trans-carveol dehydrogenase), NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2011-11-29 Release date: 2011-12-14 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Increasing the structural coverage of tuberculosis drug targets. Tuberculosis (Edinb), 95, 2015
3V2H	The crystal structure of D-beta-hydroxybutyrate dehydrogenase from Sinorhizobium meliloti Descriptor: D-beta-hydroxybutyrate dehydrogenase Authors: Zhang, Z, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, LaFleur, J, Seidel, R, Villigas, G, Zencheck, W, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) Deposit date: 2011-12-12 Release date: 2011-12-28 Last modified: 2024-10-09 Method: X-RAY DIFFRACTION (3 Å) Cite: The crystal structure of D-beta-hydroxybutyrate dehydrogenase from Sinorhizobium meliloti To be Published
8I70	Crystal structure of NADP-binding form of malonyl-CoA reductase C-domain from Chloroflexus aurantiacus Descriptor: GLYCEROL, L(+)-TARTARIC ACID, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... Authors: Kim, S, Kim, K.-J. Deposit date: 2023-01-30 Release date: 2023-06-14 Last modified: 2024-05-29 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Cryo-EM structure of bifunctional malonyl-CoA reductase from Chloroflexus aurantiacus reveals a dynamic domain movement for high enzymatic activity. Int.J.Biol.Macromol., 242, 2023
8I6Z	Crystal structure of apo-form of malonyl-CoA reductase C-domain from Chloroflexus aurantiacus Descriptor: GLYCEROL, L(+)-TARTARIC ACID, Short-chain dehydrogenase/reductase SDR Authors: Kim, S, Kim, K.-J. Deposit date: 2023-01-30 Release date: 2023-06-14 Last modified: 2024-05-29 Method: X-RAY DIFFRACTION (1.95 Å) Cite: Cryo-EM structure of bifunctional malonyl-CoA reductase from Chloroflexus aurantiacus reveals a dynamic domain movement for high enzymatic activity. Int.J.Biol.Macromol., 242, 2023
5FYD	Structural and biochemical insights into 7beta-hydroxysteroid dehydrogenase stereoselectivity Descriptor: GLYCEROL, OXIDOREDUCTASE, SHORT CHAIN DEHYDROGENASE/REDUCTASE FAMILY PROTEIN Authors: Savino, S, Ferrandi, E, Forneris, F, Rovida, S, Riva, S, Monti, D, Mattevi, A. Deposit date: 2016-03-07 Release date: 2016-04-06 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Structural and Biochemical Insights Into 7Beta-Hydroxysteroid Dehydrogenase Stereoselectivity. Proteins, 84, 2016
6DTP	CRYSTAL STRUCTURE OF HUMAN 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 COMPLEXED WITH EM139 Descriptor: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, Estradiol 17-beta-dehydrogenase 1, ... Authors: Li, T, Lin, S.X. Deposit date: 2018-06-18 Release date: 2018-09-12 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (2 Å) Cite: CRYSTAL STRUCTURE OF HUMAN 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 COMPLEXED WITH Dual-Site Inhibitor EM-139 Health, 2018
5GT9	The X-ray structure of 7beta-hydroxysteroid dehydrogenase Descriptor: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Oxidoreductase, short chain dehydrogenase/reductase family protein Authors: Wang, F, Wang, R, Lv, Z, Chen, Q, Huo, X. Deposit date: 2016-08-19 Release date: 2017-05-17 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Structure of NADP(+)-bound 7 beta-hydroxysteroid dehydrogenase reveals two cofactor-binding modes Acta Crystallogr F Struct Biol Commun, 73, 2017
6CGC	Crystal structure of human 17beta-HSD type 1 in ternary complex with 2-MeO-CC-156 and NADP+ Descriptor: 3-{[(9beta,14beta,16alpha,17alpha)-3,17-dihydroxy-2-methoxyestra-1,3,5(10)-trien-16-yl]methyl}benzamide, Estradiol 17-beta-dehydrogenase 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Li, T, Lin, S.X. Deposit date: 2018-02-19 Release date: 2019-01-16 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Combined Biophysical Chemistry Reveals a New Covalent Inhibitor with a Low-Reactivity Alkyl Halide. J Phys Chem Lett, 9, 2018
6D9Y	Crystal structure of a short chain dehydrogenase/reductase SDR from Burkholderia phymatum with partially occupied NAD Descriptor: 1,2-ETHANEDIOL, FORMIC ACID, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... Authors: Seattle Structural Genomics Center for Infectious Disease (SSGCID) Deposit date: 2018-04-30 Release date: 2018-06-06 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (1.3 Å) Cite: Crystal structure of a short chain dehydrogenase/reductase SDR from Burkholderia phymatum with partially occupied NAD To be Published
6CGE	Crystal structure of human 17beta-HSD type 1 in ternary complex with PBRM and NADP+ Descriptor: 3-{[(14beta,16alpha,17alpha)-3-(2-bromoethyl)-17-hydroxyestra-1,3,5(10)-trien-16-yl]methyl}benzamide, Estradiol 17-beta-dehydrogenase 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Li, T, Lin, S.X. Deposit date: 2018-02-20 Release date: 2019-01-16 Last modified: 2024-10-23 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Combined Biophysical Chemistry Reveals a New Covalent Inhibitor with a Low-Reactivity Alkyl Halide. J Phys Chem Lett, 9, 2018
7LG9	ChsB1 Descriptor: 3-ketoacyl-ACP reductase Authors: Yuan, T, Werman, J.M, Yin, X, Yang, M, Garcia-Diaz, M, Sampson, N.S. Deposit date: 2021-01-19 Release date: 2021-04-21 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (2.03 Å) Cite: Enzymatic beta-Oxidation of the Cholesterol Side Chain in Mycobacterium tuberculosis Bifurcates Stereospecifically at Hydration of 3-Oxo-cholest-4,22-dien-24-oyl-CoA. Acs Infect Dis., 7, 2021
7LGB	ChsB1 in complex with NAD+ Descriptor: 3-ketoacyl-ACP reductase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE Authors: Yuan, T, Werman, J.M, Yin, X, Yang, M, Garcia-Diaz, M, Sampson, N.S. Deposit date: 2021-01-19 Release date: 2021-04-21 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (2.21 Å) Cite: Enzymatic beta-Oxidation of the Cholesterol Side Chain in Mycobacterium tuberculosis Bifurcates Stereospecifically at Hydration of 3-Oxo-cholest-4,22-dien-24-oyl-CoA. Acs Infect Dis., 7, 2021
7X3Z	Crystal structure of human 17beta-hydroxysteroid dehydrogenase type 1 complexed with estrone and NAD Descriptor: (9beta,13alpha)-3-hydroxyestra-1,3,5(10)-trien-17-one, 17-beta-hydroxysteroid dehydrogenase type 1, NICOTINAMIDE-ADENINE-DINUCLEOTIDE Authors: Li, T, Lin, S.X, Yin, H. Deposit date: 2022-03-01 Release date: 2023-01-25 Last modified: 2024-05-29 Method: X-RAY DIFFRACTION (2.25 Å) Cite: New insights into the substrate inhibition of human 17 beta-hydroxysteroid dehydrogenase type 1. J.Steroid Biochem.Mol.Biol., 228, 2023
7X5J	ACP-dependent oxoacyl reductase Descriptor: 3-oxoacyl-ACP reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, PHENYLALANINE Authors: Wang, S, Bai, L. Deposit date: 2022-03-04 Release date: 2023-03-08 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (2.1 Å) Cite: ACP-dependent oxoacyl reductase To Be Published

 

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