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8 results for “co-crystal”
USP5 ZnF-UBD Co-Crystal Structure with Compound UBTR012574a
<p>Objective: To grow well-diffracting co-crystals of USP5 zinc finger ubiquitin binding domain (ZnF-UBD) to solve the co-crystal structures to determine ligand interactions in the binding pocket and to determine if the predicted binding pose is similar to the experimental binding pose.</p>
USP5 Zf-UBD Co-Crystal Structure with Compound XSR00035795a & Testing Selectivity
<p>Growth of well-diffracting co-crystals of USP5 zinc finger ubiquitin binding domain (Zf-UBD) and compound XSR00035795a to solve the structure to determine ligand interactions in the binding pocket. A surface plasmon resonance assay was used to determine if methyl group on carboxylic chain of compound XSR00035795a confers selectivity to USP5 versus HDAC6. </p>
Single crystal diffraction images for a room temperature data collection on the LEF-PG co-crystal.
<p>A set of diffraction images collected on a Rigaku FRE+ diffractometer, equipped with HF Varimax confocal mirrors and an AFC12 goniometer and HG Saturn 724+ detector diffractometer.</p> <p>The sample is an organic co-crystal that forms part of a study of the LEF active pharmaceutical ingredient with a range of coformers. The structure with the PG coformer shows strong signs of modulation in the diffraction pattern and structure refinement. The model presented in the paper (submitted to Crystal Growth and Design) does not account for any modulation and serves the purpose of a suitable degree of characterisation precision for this article. </p> <p>The authors wish to make the raw data available so that those with interest and experise in handling modulated structures can perform more detailed modelling studies and/or use the data to test software or for training examples.</p>
Co-crystal structures of USP5 Zf-UBD and weak binding compounds
<p>Determination of crystallization conditions which allow growth of well-diffracting co-crystals of USP5 zinc finger ubiquitin binding domain (Zf-UBD) and compounds shown to bind weakly by <a href="https://zenodo.org/record/1283325#.Wz5VXtJKjIV">19F NMR</a> and <a href="https://zenodo.org/record/1311686#.W0il_tJKjIU">SPR assays</a> & to solve the co-crystal structures to determine if electron density of ligands can be seen in the binding pocket of the protein domain.</p>
3D ED dataset of co-crystal of GRGDS peptide with trifluoroacetic acid (TFA)
<p>EPU-D electron diffraction dataset of the GRGDS TFA co-crystal. The original diffraction data is in MRC format, with all metadata stored in the PETS2 pts2 file. JANA files for absolute structure determination and dynamical refinement are also included.</p>
Co-crystal E-58425 vs Tramadol and Celecoxib for Moderate to Severe Acute Pain After Bunionectomy. Phase III Clinical Trial.
ClinicalTrials.gov study NCT03108482. IPD Sharing: NO. Countries: 1. Publications: 2.
Experimental Investigation of the Acetylene-Benzene Co-Crystal on Titan
<p>This folder contains corresponding FTIR spectra of the C2H2-C6H6 co-crystal (“C2H2-C6H6_co-crystal_exp”) from the manuscript “Experimental Investigation of the Acetylene-Benzene Co-Crystal on Titan." Spectra from repeated experiments (“C2H2-C6H6_co-crystal_repeat1/2”), pure spectra of C2H2 and C6H6, and a reference spectrum of acetone are also included. The spectra files are in .CSV and .SPA format.</p>
Data from: Microcrystal Electron Diffraction (MicroED) Structure Determination of a Mechanochemically Synthesized Co-crystal not Affordable from Solution Crystallization
<p>Solid-state grinding can provide “mechano-distinctive” cocrystals that are not accessible from solutions. Herein, we demonstrate the structure determination of a powdered mechano-distinctive cocrystal of 2-aminopyrimidine and succinic acid in a 2:1 molar ratio using microcrystal electron diffraction.</p>
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Allen Brain Atlas
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OpenNeuro
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