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A novel carrier-hopping mechanism of lithium transport decoupled from side chain melting in the crystalline state is postulated.
Lou, M., Dousis, A. D. & Ma, J. OPUS-PSP: An orientation dependent Statistical All-atom Potential derived from Side chain packing.
OTP-Ms and OSP-3 showed ordered phases originated from side chain crystallization, while OSP-Ms except OSP-3 showed liquid crystalline behavior.
From our results we observed that major contribution to penicillin binding proteins was observed from side chain atoms of donor residues and back bone atoms of acceptor residues [SM CH…O] in both Gram positive and Gram negative bacteria.
The often under-appreciated fact that proteins are inherently flexible, from side chain to backbone level, allows proteins to adapt to different binding sites [41], [42].
This flexibility would have to come from side chain rearrangements within the middle finger.
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One was layer structure which formed from aggregations of main chains with d-spacing of 15.7 Å (2θ=5.64°) or from side chains with d-spacing of 36.6 Å (2θ=2.41°); The other was crystallosolvate region formed within aggregation of main chains (2θ=10 35°), and the kinetics of isothermal crystallosolvate was analyzed by means of the Avirami equation.
For example, marked differences in the high angle region, 20° ≤ 2θ ≤ 25°, of the powder diffractograms, associated with reflections from side chains packing interactions were observed [63].
We also find that cancer somatic mutations and disease-related variants occur more frequently at amino acids making hydrogen bonds from side chains than neutral polymorphisms.
JOY consists of three supporting programs − SSTRUC, PSA, and HBOND − to annotate 1) the elements of secondary structure, 2) solvent accessibility, 3) hydrogen bonds from side chains, respectively.
In the HI-6sarinnonaged-mAChE structure, the carboxyamino-pyridinium ring of HI-6 is sandwiched by cation-pi interactions from side chains of Tyr124 and Trp286.
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