Results 71 to 80 of about 280,114 (200)

Challenging nickel-catalysed amine arylations enabled by tailored ancillary ligand design

open access: yesNature Communications, 2016
The development of highly effective Earth-abundant catalysts for C(sp2)-N cross-coupling represents an on-going challenge in synthetic chemistry.
Christopher M. Lavoie   +9 more
doaj   +1 more source

Blind prediction of protein B-factor and flexibility

open access: yes, 2018
Debye-Waller factor, a measure of X-ray attenuation, can be experimentally observed in protein X-ray crystallography. Previous theoretical models have made strong inroads in the analysis of B-factors by linearly fitting protein B-factors from ...
Bramer, David, Wei, Guo-Wei
core   +1 more source

Crystal structure and Hirshfeld surface analysis of a pyridiniminium bromide salt: 1-[2-(adamantan-1-yl)-2-oxoethyl]pyridin-4-iminium bromide

open access: yesActa Crystallographica Section E: Crystallographic Communications, 2018
In the cation of the title salt, C17H23N2O+·Br−, the adamantyl moiety and the pyridiniminium ring are inclined to the ketone bridge by torsion angles of −78.1 (2) (C—C—C=O) and 58.3 (2)° (C—C—N—C), respectively, and the ketone bridge has a C—C—C—N ...
Huey Chong Kwong   +4 more
doaj   +1 more source

1,3,4-Thiadiazole-Containing Azo Dyes: Synthesis, Spectroscopic Properties and Molecular Structure

open access: yesMolecules, 2020
Three series of azo dyes derived from 2-amino-5-aryl-1,3,4-thiadiazoles and aniline, N,N-dimethylaniline and phenol were synthesized in high yields by a conventional diazotization-coupling sequence.
Agnieszka Kudelko   +5 more
doaj   +1 more source

The crystal structure of Acinetobacter baumannii bacterioferritin reveals a heteropolymer of bacterioferritin and ferritin subunits

open access: yesScientific Reports
Iron storage proteins, e.g., vertebrate ferritin, and the ferritin-like bacterioferritin (Bfr) and bacterial ferritin (Ftn), are spherical, hollow proteins that catalyze the oxidation of Fe2+ at binuclear iron ferroxidase centers (FOC) and store the Fe3+
Huili Yao   +9 more
doaj   +1 more source

4-Cyano-3-fluorophenyl 4-(hexadecyloxy)benzoate

open access: yesActa Crystallographica Section E, 2014
In the title compound, C30H40FNO3, the dihedral angle between the benzene rings is 57.76 (7)°. The alkyl chain adopts an all-trans conformation. In the crystal, molecules are linked by pairs of C—H...O hydrogen bonds, forming inversion dimers.
M. K. Usha   +4 more
doaj   +1 more source

Synthesis of Meso‐Substituted Subphthalocyanine–Subporphyrin Hybrids: Boron Subtribenzodiazaporphyrins [PDF]

open access: yes, 2015
The first syntheses of hybrid structures that lie between SubPhthalocyanines and SubPorphyrins are reported. The versatile, single-step synthetic protocol uses a preformed aminoisoindolene to provide the bridging methine unit and its substituent, while ...
Andrianov   +24 more
core   +1 more source

Structural snapshot of a bacterial phytochrome in its functional intermediate state

open access: yesNature Communications, 2018
Phytochromes are photoreceptors that are present in plants, bacteria and fungi. Here the authors present crystal structures of the phytochrome Agp2 from Agrobacterium fabrum in the parent Pfr state as well as a functional Meta-F intermediate and discuss ...
Andrea Schmidt   +15 more
doaj   +1 more source

2-[(E)-2-(4-Ethoxyphenyl)ethenyl]-1-methylquinolinium 4-fluorobenzenesulfonate

open access: yesActa Crystallographica Section E, 2014
In the structure of the title salt, C20H20NO+·C6H4FO3S−, the 4-(ethoxyphenyl)ethenyl unit is disordered over two positions with a refined site-occupancy ratio of 0.610 (6):0.390 (6). The cation is nearly planar, the dihedral angle between the quinolinium
Hoong-Kun Fun   +4 more
doaj   +1 more source

The modular synthesis of rare earth-transition metal heterobimetallic complexes utilizing a redox-active ligand [PDF]

open access: yes, 2018
We report a robust and modular synthetic route to heterometallic rare earth-transition metal complexes. We have used the redox-active bridging ligand 1,10-phenathroline-5,6-dione (pd), which has selective N,N′ or O,O′ binding sites as the template for ...
Bamforth, Christopher   +6 more
core   +1 more source

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