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Engineering Hydroxylase Activity, Selectivity, and Stability for a Scalable Concise Synthesis of a Key Intermediate to Belzutifan.

Autor: Cheung-Lee WL; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Kolev JN; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., McIntosh JA; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Gil AA; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Pan W; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Xiao L; Modeling & Informatics, Discovery Chemistry, Merck & Co., Inc., Rahway, NJ 07065, USA., Velásquez JE; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Gangam R; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Winston MS; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Li S; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Abe K; Chemical Commercialization Technologies, Merck & Co., Inc., Rahway, NJ 07065, USA., Alwedi E; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Dance ZEX; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Fan H; API Process Research & Development (Biocatalysis), Shanghai STA Pharmaceutical Co., Ltd., Shanghai, 201507, China., Hiraga K; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Kim J; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Kosjek B; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Le DN; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Marzijarani NS; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Mattern K; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., McMullen JP; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Narsimhan K; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Vikram A; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Wang W; API Process Research & Development (Biocatalysis), Shanghai STA Pharmaceutical Co., Ltd., Shanghai, 201507, China., Yan JX; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Yang RS; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Zhang V; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Zhong W; Analytical Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., DiRocco DA; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Morris WJ; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Murphy GS; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA., Maloney KM; Process Research and Development, Merck & Co., Inc., Rahway, NJ 07065, USA.

Publikováno v: Angewandte Chemie (International ed. in English) [Angew Chem Int Ed Engl] 2024 Mar 22; Vol. 63 (13), pp. e202316133. Date of Electronic Publication: 2024 Feb 19.

Evaluating the Impact of the Tyr158 p K a on the Mechanism and Inhibition of InhA, the Enoyl-ACP Reductase from Mycobacterium tuberculosis .

Autor: Davoodi S; Center for Advanced Study of Drug Action, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.; Department of Chemistry, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States., Daryaee F; Center for Advanced Study of Drug Action, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.; Department of Chemistry, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States., Iuliano JN; Center for Advanced Study of Drug Action, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.; Department of Chemistry, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States., Tolentino Collado J; Center for Advanced Study of Drug Action, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.; Department of Chemistry, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States., He Y; Center for Advanced Study of Drug Action, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.; Department of Chemistry, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States., Pollard AC; Center for Advanced Study of Drug Action, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.; Department of Chemistry, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States., Gil AA; Department of Chemistry, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States., Aramini JM; Structural Biology Initiative, CUNY Advanced Science Research Center, New York, New York 10031, United States., Tonge PJ; Center for Advanced Study of Drug Action, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.; Department of Chemistry, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.; Department of Radiology, Stony Brook University, John S. Toll Drive, Stony Brook, New York 11794-3400, United States.

Publikováno v: Biochemistry [Biochemistry] 2023 Jun 20; Vol. 62 (12), pp. 1943-1952. Date of Electronic Publication: 2023 Jun 04.

Unraveling the Mechanism of a LOV Domain Optogenetic Sensor: A Glutamine Lever Induces Unfolding of the Jα Helix.

Autor: Iuliano JN; Department of Chemistry, Stony Brook University, New York, 11794, United States., Collado JT; Department of Chemistry, Stony Brook University, New York, 11794, United States., Gil AA; Department of Molecular Biology, Princeton University, Princeton, New Jersey 08544, United States., Ravindran PT; Department of Molecular Biology, Princeton University, Princeton, New Jersey 08544, United States., Lukacs A; School of Chemistry, University of East Anglia, Norwich, NR4 7TJ, United Kingdom.; Department of Biophysics, Medical School, University of Pecs, Szigeti út 12, 7624 Pecs, Hungary., Shin S; Department of Chemistry, Stony Brook University, New York, 11794, United States., Woroniecka HA; Department of Chemistry, Stony Brook University, New York, 11794, United States., Adamczyk K; School of Chemistry, University of East Anglia, Norwich, NR4 7TJ, United Kingdom., Aramini JM; Structural Biology Initiative, CUNY Advanced Science Research Center, 85 St. Nicholas Terrace, New York, New York 10031, United States., Edupuganti UR; Structural Biology Initiative, CUNY Advanced Science Research Center, 85 St. Nicholas Terrace, New York, New York 10031, United States.; Ph.D. Program in Biochemistry, CUNY Graduate Center, New York, New York, United States., Hall CR; School of Chemistry, University of East Anglia, Norwich, NR4 7TJ, United Kingdom., Greetham GM; Central Laser Facility, Research Complex at Harwell, Rutherford Appleton Laboratory, Didcot, OX11 0QX, United Kingdom., Sazanovich IV; Central Laser Facility, Research Complex at Harwell, Rutherford Appleton Laboratory, Didcot, OX11 0QX, United Kingdom., Clark IP; Central Laser Facility, Research Complex at Harwell, Rutherford Appleton Laboratory, Didcot, OX11 0QX, United Kingdom., Daryaee T; Department of Chemistry, Stony Brook University, New York, 11794, United States., Toettcher JE; Department of Molecular Biology, Princeton University, Princeton, New Jersey 08544, United States., French JB; Department of Chemistry, Stony Brook University, New York, 11794, United States.; Hormel Institute, University of Minnesota, Austin, Minnesota 55912, United States., Gardner KH; Structural Biology Initiative, CUNY Advanced Science Research Center, 85 St. Nicholas Terrace, New York, New York 10031, United States.; Ph.D. Programs in Biochemistry, Biology, and Chemistry, CUNY Graduate Center, New York, New York, United States.; Department of Chemistry and Biochemistry, City College of New York, New York, New York, United States., Simmerling CL; Department of Chemistry, Stony Brook University, New York, 11794, United States., Meech SR; School of Chemistry, University of East Anglia, Norwich, NR4 7TJ, United Kingdom., Tonge PJ; Department of Chemistry, Stony Brook University, New York, 11794, United States.

Publikováno v: ACS chemical biology [ACS Chem Biol] 2020 Oct 16; Vol. 15 (10), pp. 2752-2765. Date of Electronic Publication: 2020 Sep 18.