Detalhe da pesquisa
1.
Hydroperoxidation of Docosahexaenoic Acid by Human ALOX12 and pigALOX15-mini-LOX.
Int J Mol Sci
; 24(7)2023 Mar 23.
Artigo
em Inglês
| MEDLINE | ID: mdl-37047037
2.
Functional Characterization of Mouse and Human Arachidonic Acid Lipoxygenase 15B (ALOX15B) Orthologs and of Their Mutants Exhibiting Humanized and Murinized Reaction Specificities.
Int J Mol Sci
; 24(12)2023 Jun 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-37373195
3.
Different Structures-Similar Effect: Do Substituted 5-(4-Methoxyphenyl)-1H-indoles and 5-(4-Methoxyphenyl)-1H-imidazoles Represent a Common Pharmacophore for Substrate Selective Inhibition of Linoleate Oxygenase Activity of ALOX15?
Molecules
; 28(14)2023 Jul 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-37513289
4.
Three-Photon Infrared Stimulation of Endogenous Neuroreceptors in Vivo.
Angew Chem Int Ed Engl
; 62(51): e202311181, 2023 Dec 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-37823736
5.
The role of acetylated cyclooxygenase-2 in the biosynthesis of resolvin precursors derived from eicosapentaenoic acid.
Org Biomol Chem
; 20(6): 1260-1274, 2022 02 09.
Artigo
em Inglês
| MEDLINE | ID: mdl-35067692
6.
On the Computational Design of Azobenzene-Based Multi-State Photoswitches.
Int J Mol Sci
; 23(15)2022 Aug 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-35955820
7.
Predicting the Electronic Absorption Band Shape of Azobenzene Photoswitches.
Int J Mol Sci
; 24(1)2022 Dec 20.
Artigo
em Inglês
| MEDLINE | ID: mdl-36613468
8.
Theoretical Characterization of the Step-by-Step Mechanism of Conversion of Leukotriene A4 to Leukotriene B4 Catalysed by the Enzyme Leukotriene A4 Hydrolase.
Int J Mol Sci
; 23(6)2022 Mar 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-35328561
9.
Accounting for the instantaneous disorder in the enzyme-substrate Michaelis complex to calculate the Gibbs free energy barrier of an enzyme reaction.
Phys Chem Chem Phys
; 23(23): 13042-13054, 2021 Jun 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-34100037
10.
Conformational Heterogeneity and Cooperative Effects of Mammalian ALOX15.
Int J Mol Sci
; 22(6)2021 Mar 23.
Artigo
em Inglês
| MEDLINE | ID: mdl-33807076
11.
A protocol to obtain multidimensional quantum tunneling corrections derived from QM(DFT)/MM calculations for an enzyme reaction.
Phys Chem Chem Phys
; 22(46): 27385-27393, 2020 Dec 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-33231218
12.
Deciphering the grounds of the suitability of acylhydrazones as efficient photoswitches.
Phys Chem Chem Phys
; 21(29): 16075-16082, 2019 Aug 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-31290500
13.
Evolutionary alteration of ALOX15 specificity optimizes the biosynthesis of antiinflammatory and proresolving lipoxins.
Proc Natl Acad Sci U S A
; 113(30): E4266-75, 2016 07 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-27412860
14.
Mutagenesis of Sequence Determinants of Truncated Porcine ALOX15 Induces Changes in the Reaction Specificity by Altering the Catalytic Mechanism of Initial Hydrogen Abstraction.
Chemistry
; 24(4): 962-973, 2018 Jan 19.
Artigo
em Inglês
| MEDLINE | ID: mdl-29154477
15.
Ultrafast action chemistry in slow motion: atomistic description of the excitation and fluorescence processes in an archetypal fluorescent protein.
Phys Chem Chem Phys
; 20(16): 11067-11080, 2018 Apr 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-29620123
16.
Computational insights into active site shaping for substrate specificity and reaction regioselectivity in the EXTL2 retaining glycosyltransferase.
Org Biomol Chem
; 15(43): 9095-9107, 2017 Nov 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-28905966
17.
Understanding how cAMP-dependent protein kinase can catalyze phosphoryl transfer in the presence of Ca2+ and Sr2+: a QM/MM study.
Phys Chem Chem Phys
; 19(16): 10377-10394, 2017 Apr 19.
Artigo
em Inglês
| MEDLINE | ID: mdl-28379230
18.
Inhibition of Mammalian 15-Lipoxygenase by Three Ebselen-like Drugs. A QM/MM and MM/PBSA Comparative Study.
J Phys Chem A
; 121(51): 9752-9763, 2017 Dec 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-29182862
19.
The Quest for Photoswitches Activated by Near-Infrared Light: A Theoretical Study of the Photochemistry of BF2 -Coordinated Azo Derivatives.
Chemphyschem
; 17(18): 2824-38, 2016 Sep 19.
Artigo
em Inglês
| MEDLINE | ID: mdl-27324614
20.
Is Regioselectivity in the Enzyme-Catalyzed Hydroperoxidation of Arachidonic Acid Necessarily Determined by Hydrogen Abstraction? The Case of Rabbit Leu597Ala/Ile663Ala ALOX15 Mutant.
Chemphyschem
; 17(20): 3321-3332, 2016 Oct 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-27459330