Research Data Supporting "Substrate fragmentation for the design of M. tuberculosis CYP121 inhibitors"
Kavanagh, Madeline E.
Gray, Janine L.
Gilbert, Sophie H.
Coyne, Anthony G.
McLean, Kirsty J.
Davis, Holly J.
Munro, Andrew W.
University of Cambridge
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Kavanagh, M. E., Gray, J. L., Gilbert, S. H., Coyne, A. G., McLean, K. J., Davis, H. J., Munro, A. W., & et al. (2016). Research Data Supporting "Substrate fragmentation for the design of M. tuberculosis CYP121 inhibitors" [Dataset]. https://doi.org/10.17863/CAM.354
This data is submitted in support of the manuscript entitled "Substrate fragmentation for the design of M. tuberculosis CYP121 inhibitors", which has been accepted for publication in the journal ChemMedChem, and has the DOI: 10.1002/cmdc.201600248. The characterisation data (IR, HRMS, LCMS, NMR) for compounds synthesised in this research are provided as PDF files. The EPR (narrow and wide scan) raw data is provided for compounds as csv files. The difference spectra for the titration of CYP121 with the ligands described in the study are provided as csv files.
adobe, excel, origin
CYP121, Mycobacterium tuberculosis, substrate fragmentation, fragment-based drug discovery
Publication Reference: https://www.repository.cam.ac.uk/handle/1810/256951
Wellcome Trust (GR080083/Z/06)
Cambridge Commonwealth Trust and Cambridge Overseas Trust (AUCR-2013-3)
This record's DOI: https://doi.org/10.17863/CAM.354
Attribution 4.0 International
Licence URL: http://creativecommons.org/licenses/by/4.0/
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