Mechanism of Calcium Permeation in a Glutamate Receptor Ion Channel.


Journal

Journal of chemical information and modeling
ISSN: 1549-960X
Titre abrégé: J Chem Inf Model
Pays: United States
ID NLM: 101230060

Informations de publication

Date de publication:
27 02 2023
Historique:
pubmed: 10 2 2023
medline: 3 3 2023
entrez: 9 2 2023
Statut: ppublish

Résumé

The α-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid receptors (AMPARs) are neurotransmitter-activated cation channels ubiquitously expressed in vertebrate brains. The regulation of calcium flux through the channel pore by RNA-editing is linked to synaptic plasticity while excessive calcium influx poses a risk for neurodegeneration. Unfortunately, the molecular mechanisms underlying this key process are mostly unknown. Here, we investigated calcium conduction in calcium-permeable AMPAR using Molecular Dynamics (MD) simulations with recently introduced multisite force-field parameters for Ca

Identifiants

pubmed: 36758214
doi: 10.1021/acs.jcim.2c01494
pmc: PMC9976283
doi:

Substances chimiques

Calcium SY7Q814VUP
Receptors, Glutamate 0
Ion Channels 0

Types de publication

Journal Article Research Support, Non-U.S. Gov't

Langues

eng

Sous-ensembles de citation

IM

Pagination

1293-1300

Références

Chemistry. 2013 Feb 25;19(9):3047-60
pubmed: 23315704
Chemphyschem. 2005 Sep 5;6(9):1715-8
pubmed: 16080223
Nat Commun. 2018 Feb 19;9(1):717
pubmed: 29459730
Acta Crystallogr D Biol Crystallogr. 2010 Apr;66(Pt 4):486-501
pubmed: 20383002
Neuron. 1995 Jul;15(1):193-204
pubmed: 7619522
Acta Crystallogr D Struct Biol. 2019 Oct 1;75(Pt 10):861-877
pubmed: 31588918
Proc Natl Acad Sci U S A. 2014 Mar 4;111(9):3454-9
pubmed: 24550503
J Chem Theory Comput. 2019 Jun 11;15(6):3810-3823
pubmed: 30998344
J Phys Chem Lett. 2021 May 6;12(17):4286-4291
pubmed: 33909426
Proteins. 2010 Jun;78(8):1950-8
pubmed: 20408171
J Physiol. 1995 Jun 1;485 ( Pt 2):403-18
pubmed: 7666365
Proc Natl Acad Sci U S A. 2021 Feb 23;118(8):
pubmed: 33602810
J Chem Theory Comput. 2012 May 8;8(5):1629-40
pubmed: 26593656
J Am Chem Soc. 2001 Jan 24;123(3):431-41
pubmed: 11456545
J Am Chem Soc. 2021 Aug 11;143(31):12181-12193
pubmed: 34323472
Nature. 2017 Sep 7;549(7670):60-65
pubmed: 28737760
Biophys Chem. 2006 Dec 1;124(3):292-301
pubmed: 16737771
Nat Commun. 2013;4:2721
pubmed: 24217363
R Soc Open Sci. 2017 Jan 4;4(1):160671
pubmed: 28280569
Nat Commun. 2020 Feb 17;11(1):922
pubmed: 32066742
J Chem Phys. 2007 Aug 21;127(7):074503
pubmed: 17718616
J Gen Physiol. 1988 Jul;92(1):1-26
pubmed: 2459298
J Chem Phys. 2014 Aug 28;141(8):084502
pubmed: 25173016
Proc Natl Acad Sci U S A. 2015 Jul 7;112(27):E3619-28
pubmed: 26100907
Phys Rev B Condens Matter. 1988 Jan 15;37(2):785-789
pubmed: 9944570
Nat Chem. 2018 Aug;10(8):813-820
pubmed: 30030538
J Am Chem Soc. 2004 Feb 4;126(4):1020-1
pubmed: 14746460
Proc Natl Acad Sci U S A. 2011 Jan 11;108(2):592-7
pubmed: 21187429
J Phys Chem B. 2016 Mar 3;120(8):1885-93
pubmed: 26788746
Cell Mol Life Sci. 2021 Jul;78(14):5605-5630
pubmed: 34100982
J Am Chem Soc. 2012 Jan 25;134(3):1840-6
pubmed: 22191670
Neuron. 1992 Jan;8(1):189-98
pubmed: 1370372
J Mol Biol. 2023 Jan 20;435(6):167970
pubmed: 36682679
J Phys Chem B. 2010 Mar 4;114(8):2549-64
pubmed: 20136072
Proc Natl Acad Sci U S A. 2018 May 22;115(21):5450-5455
pubmed: 29735669
J Am Chem Soc. 2020 May 20;142(20):9415-9427
pubmed: 32336093
Neuron. 2006 Mar 2;49(5):719-33
pubmed: 16504947
J Chem Phys. 2019 Apr 28;150(16):164120
pubmed: 31042914
Front Mol Biosci. 2020 Mar 20;7:45
pubmed: 32266290
J Physiol. 2019 Feb;597(3):679-698
pubmed: 30471114
Science. 1991 May 10;252(5007):851-3
pubmed: 1709304
Annu Rev Biophys Biomol Struct. 2005;34:153-71
pubmed: 15869387
J Mol Biol. 2007 Feb 16;366(2):687-701
pubmed: 17174326
Chemphyschem. 2017 Oct 6;18(19):2807-2811
pubmed: 28510283
Neuron. 2016 Mar 2;89(5):1000-15
pubmed: 26938443
Phys Rev A Gen Phys. 1988 Sep 15;38(6):3098-3100
pubmed: 9900728
Science. 1991 Jun 21;252(5013):1715-8
pubmed: 1710829
Cell. 2016 Sep 22;167(1):145-157.e17
pubmed: 27662087
Chem Rev. 2019 Jul 10;119(13):7737-7832
pubmed: 31246417
Biophys J. 2011 Aug 17;101(4):809-17
pubmed: 21843471
J Phys Chem Lett. 2021 Oct 7;12(39):9449-9454
pubmed: 34555284
J Chem Theory Comput. 2019 Oct 8;15(10):5601-5613
pubmed: 31498615
Nature. 2009 Dec 10;462(7274):745-56
pubmed: 19946266
J Chem Theory Comput. 2021 Mar 9;17(3):1726-1741
pubmed: 33539082
Nature. 2021 Jun;594(7863):454-458
pubmed: 34079129
J Comput Chem. 2013 Sep 30;34(25):2135-45
pubmed: 23832629
Chem Rev. 2016 May 11;116(9):4983-5013
pubmed: 26815602
Cell. 2017 Sep 7;170(6):1234-1246.e14
pubmed: 28823560
Pharmacol Rev. 2021 Oct;73(4):298-487
pubmed: 34753794
J Phys Chem Lett. 2020 Aug 6;11(15):6373-6381
pubmed: 32672983

Auteurs

Florian Karl Schackert (FK)

Computational Biomedicine (IAS-5/INM-9), Forschungszentrum Jülich GmbH, 52428 Jülich, Germany.
Department of Physics, RWTH Aachen University, 52062 Aachen, Germany.

Johann Biedermann (J)

Institute of Biology, Cellular Biophysics, Humboldt Universität zu Berlin, 10115 Berlin, Germany.
Leibniz Forschungsinstitut für Molekulare Pharmakologie, 13125 Berlin, Germany.

Saeid Abdolvand (S)

Institute of Biology, Cellular Biophysics, Humboldt Universität zu Berlin, 10115 Berlin, Germany.
Leibniz Forschungsinstitut für Molekulare Pharmakologie, 13125 Berlin, Germany.

Sonja Minniberger (S)

Institute of Biology, Cellular Biophysics, Humboldt Universität zu Berlin, 10115 Berlin, Germany.
Leibniz Forschungsinstitut für Molekulare Pharmakologie, 13125 Berlin, Germany.

Chen Song (C)

Center for Quantitative Biology, Academy for Advanced Interdisciplinary Studies, Peking University, Beijing, 100871, China.
Peking-Tsinghua Center for Life Sciences, Academy for Advanced Interdisciplinary Studies, Peking University, Beijing, 100871, China.

Andrew J R Plested (AJR)

Institute of Biology, Cellular Biophysics, Humboldt Universität zu Berlin, 10115 Berlin, Germany.
Leibniz Forschungsinstitut für Molekulare Pharmakologie, 13125 Berlin, Germany.

Paolo Carloni (P)

Computational Biomedicine (IAS-5/INM-9), Forschungszentrum Jülich GmbH, 52428 Jülich, Germany.
Department of Physics, RWTH Aachen University, 52062 Aachen, Germany.

Han Sun (H)

Leibniz Forschungsinstitut für Molekulare Pharmakologie, 13125 Berlin, Germany.
Institute of Chemistry, TU Berlin, Straße des 17 Juni 135, 10623 Berlin, Germany.

Articles similaires

Photosynthesis Ribulose-Bisphosphate Carboxylase Carbon Dioxide Molecular Dynamics Simulation Cyanobacteria
Psoriasis Humans Magnesium Zinc Trace Elements

The FGF/FGFR/c-Myc axis as a promising therapeutic target in multiple myeloma.

Arianna Giacomini, Sara Taranto, Giorgia Gazzaroli et al.
1.00
Humans Multiple Myeloma Receptors, Fibroblast Growth Factor Fibroblast Growth Factors Proto-Oncogene Proteins c-myc
Animals Lung India Sheep Transcriptome

Classifications MeSH