Ion-dependent protein-surface interactions from intrinsic solvent response.
Landau theory
electrostatics
soft matter
solution assembly
specific ion effects
Journal
Proceedings of the National Academy of Sciences of the United States of America
ISSN: 1091-6490
Titre abrégé: Proc Natl Acad Sci U S A
Pays: United States
ID NLM: 7505876
Informations de publication
Date de publication:
29 06 2021
29 06 2021
Historique:
entrez:
26
6
2021
pubmed:
27
6
2021
medline:
15
12
2021
Statut:
ppublish
Résumé
The phyllosilicate mineral muscovite mica is widely used as a surface template for the patterning of macromolecules, yet a molecular understanding of its surface chemistry under varying solution conditions, required to predict and control the self-assembly of adsorbed species, is lacking. We utilize all-atom molecular dynamics simulations in conjunction with an electrostatic analysis based in local molecular field theory that affords a clean separation of long-range and short-range electrostatics. Using water polarization response as a measure of the electric fields that arise from patterned, surface-bound ions that direct the adsorption of charged macromolecules, we apply a Landau theory of forces induced by asymmetrically polarized surfaces to compute protein-surface interactions for two muscovite-binding proteins (DHR10-mica6 and
Identifiants
pubmed: 34172582
pii: 2025121118
doi: 10.1073/pnas.2025121118
pmc: PMC8255788
pii:
doi:
Substances chimiques
Aluminum Silicates
0
Ions
0
Proteins
0
Solvents
0
muscovite
0
Water
059QF0KO0R
mica
V8A1AW0880
Types de publication
Journal Article
Research Support, Non-U.S. Gov't
Research Support, U.S. Gov't, Non-P.H.S.
Langues
eng
Sous-ensembles de citation
IM
Déclaration de conflit d'intérêts
The authors declare no competing interest.
Références
Proc Natl Acad Sci U S A. 2016 Mar 15;113(11):2819-26
pubmed: 26929375
J Phys Chem B. 2008 Jul 31;112(30):9020-41
pubmed: 18593145
ACS Nano. 2012 Jan 24;6(1):190-8
pubmed: 22148246
Science. 2015 Aug 7;349(6248):1255555
pubmed: 26250687
Langmuir. 2011 Sep 6;27(17):10907-13
pubmed: 21740026
Entropy (Basel). 2018 May 12;20(5):
pubmed: 33265452
J Phys Chem Lett. 2017 Dec 7;8(23):5707-5711
pubmed: 29120643
Chem Rev. 2016 Nov 23;116(22):13571-13632
pubmed: 27587089
Proc Natl Acad Sci U S A. 2006 May 16;103(20):7560-5
pubmed: 16670200
Acc Chem Res. 2010 May 18;43(5):661-72
pubmed: 20192262
Nat Chem. 2018 Jul;10(7):732-739
pubmed: 29713036
Microbiol Rev. 1988 Dec;52(4):452-84
pubmed: 3070320
J Appl Crystallogr. 2017 May 25;50(Pt 3):712-721
pubmed: 28656036
Annu Rev Phys Chem. 2002;53:533-62
pubmed: 11972018
Phys Chem Chem Phys. 2018 Mar 28;20(13):8432-8449
pubmed: 29547221
Nat Commun. 2017 Oct 10;8(1):835
pubmed: 29018200
Adv Mater. 2021 Jun;33(23):e1905784
pubmed: 32627885
Science. 2012 May 25;336(6084):1014-8
pubmed: 22628650
Nature. 2016 May 02;533(7603):369-73
pubmed: 27135928
Nature. 2015 Dec 24;528(7583):580-4
pubmed: 26675729
J Phys Chem Lett. 2019 Sep 5;10(17):5200-5205
pubmed: 31433642
Nanoscale. 2016 Dec 1;8(47):19714-19725
pubmed: 27874139
Nat Commun. 2014 Sep 10;5:4889
pubmed: 25205175
Nature. 2019 Jul;571(7764):251-256
pubmed: 31292559
Nat Commun. 2020 Jul 28;11(1):3770
pubmed: 32724112
Langmuir. 2008 Dec 2;24(23):13276-8
pubmed: 18973309
J Am Chem Soc. 2020 Oct 21;142(42):17956-17965
pubmed: 32985179
ACS Nano. 2018 Dec 26;12(12):11785-11797
pubmed: 30422619
Chem Rev. 2016 Sep 28;116(18):11220-89
pubmed: 27552640
J Phys Chem Lett. 2016 Jun 16;7(12):2157-63
pubmed: 27216986
Cold Spring Harb Perspect Biol. 2010 May;2(5):a002162
pubmed: 20452963
J Comput Chem. 2019 Oct 15;40(27):2418-2431
pubmed: 31260119
Proc Natl Acad Sci U S A. 2017 Jul 18;114(29):7537-7542
pubmed: 28679632
J Chem Theory Comput. 2018 Oct 9;14(10):4985-4990
pubmed: 30075630
J Phys Chem Lett. 2020 Oct 15;11(20):8682-8689
pubmed: 32955892
Nat Commun. 2016 Jul 15;7:12164
pubmed: 27416784
Nat Commun. 2020 Feb 25;11(1):1045
pubmed: 32098968
J Colloid Interface Sci. 2021 Feb 15;584:610-621
pubmed: 33223241
J Phys Chem B. 2015 Jul 23;119(29):9268-77
pubmed: 25402636
Phys Chem Chem Phys. 2020 May 21;22(19):10676-10686
pubmed: 32025669
J Comput Chem. 2013 Sep 30;34(25):2135-45
pubmed: 23832629
Sci Rep. 2017 Feb 23;7:43234
pubmed: 28230209
Angew Chem Int Ed Engl. 2012 Jul 2;51(27):6582-96
pubmed: 22639420
Langmuir. 2013 Feb 12;29(6):1754-65
pubmed: 23276161
Adv Colloid Interface Sci. 2014 Jun;208:142-52
pubmed: 24612664