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Items: 29

1.

The Pore-Lipid Interface: Role of Amino-Acid Determinants of Lipophilic Access by Ivabradine to the hERG1 Pore Domain.

Perissinotti L, Guo J, Kudaibergenova M, Lees-Miller J, Ol'khovich M, Sharapova A, Perlovich GL, Muruve DA, Gerull B, Noskov SY, Duff HJ.

Mol Pharmacol. 2019 Aug;96(2):259-271. doi: 10.1124/mol.118.115642. Epub 2019 Jun 10.

PMID:
31182542
2.

Lipid roles in hERG function and interactions with drugs.

Kudaibergenova M, Perissinotti LL, Noskov SY.

Neurosci Lett. 2019 May 1;700:70-77. doi: 10.1016/j.neulet.2018.05.019. Epub 2018 May 27. Review.

PMID:
29758301
3.

Determinants of Isoform-Specific Gating Kinetics of hERG1 Channel: Combined Experimental and Simulation Study.

Perissinotti LL, De Biase PM, Guo J, Yang PC, Lee MC, Clancy CE, Duff HJ, Noskov SY.

Front Physiol. 2018 Apr 12;9:207. doi: 10.3389/fphys.2018.00207. eCollection 2018.

4.

Computational membrane biophysics: From ion channel interactions with drugs to cellular function.

Miranda WE, Ngo VA, Perissinotti LL, Noskov SY.

Biochim Biophys Acta Proteins Proteom. 2017 Nov;1865(11 Pt B):1643-1653. doi: 10.1016/j.bbapap.2017.08.008. Epub 2017 Aug 26. Review.

5.

A multiscale computational modelling approach predicts mechanisms of female sex risk in the setting of arousal-induced arrhythmias.

Yang PC, Perissinotti LL, López-Redondo F, Wang Y, DeMarco KR, Jeng MT, Vorobyov I, Harvey RD, Kurokawa J, Noskov SY, Clancy CE.

J Physiol. 2017 Jul 15;595(14):4695-4723. doi: 10.1113/JP273142. Epub 2017 Jun 14.

6.

Mapping Ryanodine Binding Sites in the Pore Cavity of Ryanodine Receptors.

Ngo VA, Perissinotti LL, Miranda W, Chen SRW, Noskov SY.

Biophys J. 2017 Apr 25;112(8):1645-1653. doi: 10.1016/j.bpj.2017.03.014.

7.

Computational Models for Understanding of Structure, Function and Pharmacology of the Cardiac Potassium Channel Kv11.1 (hERG).

Wacker S, Noskov SY, Perissinotti LL.

Curr Top Med Chem. 2017;17(23):2681-2702. doi: 10.2174/1568026617666170414143430. Review.

PMID:
28413954
8.

Role of the pH in state-dependent blockade of hERG currents.

Wang Y, Guo J, Perissinotti LL, Lees-Miller J, Teng G, Durdagi S, Duff HJ, Noskov SY.

Sci Rep. 2016 Oct 12;6:32536. doi: 10.1038/srep32536.

9.

In response to Melgari et al. "hERG potassium channel inhibition by ivabradine requires channel gating".

Lees-Miller JP, Guo J, Wang Y, Perissinotti LL, Noskov SY, Duff HJ.

J Mol Cell Cardiol. 2015 Oct;87:192-3. doi: 10.1016/j.yjmcc.2015.08.003. Epub 2015 Aug 20. No abstract available.

PMID:
26299838
10.

Ivabradine prolongs phase 3 of cardiac repolarization and blocks the hERG1 (KCNH2) current over a concentration-range overlapping with that required to block HCN4.

Lees-Miller JP, Guo J, Wang Y, Perissinotti LL, Noskov SY, Duff HJ.

J Mol Cell Cardiol. 2015 Aug;85:71-8. doi: 10.1016/j.yjmcc.2015.05.009. Epub 2015 May 16.

PMID:
25986146
11.

Kinetic model for NS1643 drug activation of WT and L529I variants of Kv11.1 (hERG1) potassium channel.

Perissinotti LL, Guo J, De Biase PM, Clancy CE, Duff HJ, Noskov SY.

Biophys J. 2015 Mar 24;108(6):1414-1424. doi: 10.1016/j.bpj.2014.12.056.

12.

NS1643 interacts around L529 of hERG to alter voltage sensor movement on the path to activation.

Guo J, Cheng YM, Lees-Miller JP, Perissinotti LL, Claydon TW, Hull CM, Thouta S, Roach DE, Durdagi S, Noskov SY, Duff HJ.

Biophys J. 2015 Mar 24;108(6):1400-1413. doi: 10.1016/j.bpj.2014.12.055.

13.

Structure driven design of novel human ether-a-go-go-related-gene channel (hERG1) activators.

Guo J, Durdagi S, Changalov M, Perissinotti LL, Hargreaves JM, Back TG, Noskov SY, Duff HJ.

PLoS One. 2014 Sep 5;9(9):e105553. doi: 10.1371/journal.pone.0105553. eCollection 2014.

14.

Thiol redox biochemistry: insights from computer simulations.

Zeida A, Guardia CM, Lichtig P, Perissinotti LL, Defelipe LA, Turjanski A, Radi R, Trujillo M, Estrin DA.

Biophys Rev. 2014 Mar;6(1):27-46. doi: 10.1007/s12551-013-0127-x. Epub 2014 Jan 9. Review.

15.

Small ligand-globin interactions: reviewing lessons derived from computer simulation.

Capece L, Boechi L, Perissinotti LL, Arroyo-Mañez P, Bikiel DE, Smulevich G, Marti MA, Estrin DA.

Biochim Biophys Acta. 2013 Sep;1834(9):1722-38. doi: 10.1016/j.bbapap.2013.02.038. Epub 2013 Mar 5. Review.

PMID:
23470499
16.

Folate binding site of flavin-dependent thymidylate synthase.

Koehn EM, Perissinotti LL, Moghram S, Prabhakar A, Lesley SA, Mathews II, Kohen A.

Proc Natl Acad Sci U S A. 2012 Sep 25;109(39):15722-7. Epub 2012 Sep 10.

17.

Effects of the donor-acceptor distance and dynamics on hydride tunneling in the dihydrofolate reductase catalyzed reaction.

Stojković V, Perissinotti LL, Willmer D, Benkovic SJ, Kohen A.

J Am Chem Soc. 2012 Jan 25;134(3):1738-45. doi: 10.1021/ja209425w. Epub 2012 Jan 17.

18.

Addition and redox reactivity of hydrogen sulfides (H2S/HS⁻) with nitroprusside: new chemistry of nitrososulfide ligands.

Quiroga SL, Almaraz AE, Amorebieta VT, Perissinotti LL, Olabe JA.

Chemistry. 2011 Apr 4;17(15):4145-56. doi: 10.1002/chem.201002322. Epub 2011 Mar 14.

PMID:
21404343
19.

The effect of active-site isoleucine to alanine mutation on the DHFR catalyzed hydride-transfer.

Stojković V, Perissinotti LL, Lee J, Benkovic SJ, Kohen A.

Chem Commun (Camb). 2010 Dec 21;46(47):8974-6. doi: 10.1039/c0cc02988b. Epub 2010 Oct 25.

20.

A microscopic study of the deoxyhemoglobin-catalyzed generation of nitric oxide from nitrite anion.

Perissinotti LL, Marti MA, Doctorovich F, Luque FJ, Estrin DA.

Biochemistry. 2008 Sep 16;47(37):9793-802. doi: 10.1021/bi801104c. Epub 2008 Aug 22.

PMID:
18717599
21.

A unique family of stable and water-soluble S-nitrosothiol complexes.

Perissinotti LL, Leitus G, Shimon L, Estrin D, Doctorovich F.

Inorg Chem. 2008 Jun 2;47(11):4723-33. doi: 10.1021/ic7024999. Epub 2008 May 9.

PMID:
18465851
22.

Electrospray ionization mass spectrometry of a novel family of complexes in which various nitroso compounds are stabilized via coordination to [IrCl5]2-.

Escola N, Di Salvo F, Haddad R, Perissinotti L, Eberlin MN, Doctorovich F.

Inorg Chem. 2007 Jun 11;46(12):4827-34. Epub 2007 May 12.

PMID:
17497846
23.

Modeling heme proteins using atomistic simulations.

Bikiel DE, Boechi L, Capece L, Crespo A, De Biase PM, Di Lella S, González Lebrero MC, Martí MA, Nadra AD, Perissinotti LL, Scherlis DA, Estrin DA.

Phys Chem Chem Phys. 2006 Dec 28;8(48):5611-28. Epub 2006 Oct 11. Review.

PMID:
17149482
24.

Solvent effects on peroxynitrite structure and properties from QM/MM simulations.

Gonzalez Lebrero MC, Perissinotti LL, Estrin DA.

J Phys Chem A. 2005 Oct 27;109(42):9598-604.

PMID:
16866413
25.

A surprisingly stable S-nitrosothiol complex.

Perissinotti LL, Estrin DA, Leitus G, Doctorovich F.

J Am Chem Soc. 2006 Mar 1;128(8):2512-3.

PMID:
16492016
26.

Transnitrosation of nitrosothiols: characterization of an elusive intermediate.

Perissinotti LL, Turjanski AG, Estrin DA, Doctorovich F.

J Am Chem Soc. 2005 Jan 19;127(2):486-7.

PMID:
15643848
27.

Semiquinone production by lipophilic o-naphthoquinones.

Villamil SH, Dubin M, Portela MP, Perissinotti LJ, Brusa MA, Stoppani AO.

Redox Rep. 1997 Aug;3(4):245-52. doi: 10.1080/13510002.1997.11747117.

PMID:
27415027
28.

Redox cycling of o-naphthoquinones in trypanosomatids. Superoxide and hydrogen peroxide production.

Molina Portela MP, Fernandez Villamil SH, Perissinotti LJ, Stoppani AO.

Biochem Pharmacol. 1996 Dec 24;52(12):1875-82.

PMID:
8951346
29.

Generation of radical anions of nifurtimox and related nitrofuran compounds by ascorbate.

Fernandez Villamil SH, Dubin M, Brusa MA, Duran RP, Perissinotti LJ, Stoppani AO.

Free Radic Res Commun. 1990;10(6):351-60.

PMID:
2175283

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