B–H⋯π and C–H⋯π interactions in protein–ligand complexes: carbonic anhydrase II inhibition by carborane sulfonamides-Reference-Cited by-同舟云学术

B–H⋯π and C–H⋯π interactions in protein–ligand complexes: carbonic anhydrase II inhibition by carborane sulfonamides

Published:2023 Issue:3 Volume:25 Page:1728-1733
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Fanfrlík Jindřich¹^ORCID,Brynda Jiří¹,Kugler Michael¹^ORCID,Lepšík Martin¹^ORCID,Pospíšilová Klára¹,Holub Josef²,Hnyk Drahomír²^ORCID,Nekvinda Jan²^ORCID,Grüner Bohumír²^ORCID,Řezáčová Pavlína¹

Affiliation:

1. Institute of Organic Chemistry and Biochemistry of the Czech Academy of Sciences, Flemingovo nam. 2, 166 10, Prague 6, Czech Republic

2. Institute of Inorganic Chemistry of the Czech Academy of Sciences, 250 68 Husinec-Řež, Czech Republic

Abstract

The first crystallographic and quantum chemical evidence of B–H⋯π interaction in a protein–ligand complex is presented.

Funder

European Regional Development Fund

Grantová Agentura České Republiky

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D2CP04673C

Reference44 articles.

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2. Nanocage Encapsulation of Twoortho-Carborane Molecules

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5. Dihydrogen Bonding: Structures, Energetics, and Dynamics

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