| dc.contributor |
BBSRC - Biotechnology and Biological Sciences Research Council |
|
| dc.contributor |
EPSRC - Engineering and Physical Sciences Research Council |
|
| dc.contributor |
Kelly, Van |
|
| dc.creator |
Ekström, Alex |
|
| dc.creator |
Kelly, Van |
|
| dc.creator |
Marles-Wright, Jon |
|
| dc.creator |
Cockroft, Scott |
|
| dc.creator |
Campopiano, Dominic |
|
| dc.date |
2017-07-26T15:28:17Z |
|
| dc.date |
2017-07-26T15:28:17Z |
|
| dc.date.accessioned |
2023-02-17T20:52:34Z |
|
| dc.date.available |
2023-02-17T20:52:34Z |
|
| dc.identifier |
Ekström, Alex; Kelly, Van; Marles-Wright, Jon; Cockroft, Scott; Campopiano, Dominic. (2017). Structural evidence for the covalent modification of FabH by 4,5-dichloro-1,2-dithiol-3-one (HR45), [dataset]. University of Edinburgh. School of Chemistry. https://doi.org/10.7488/ds/2103. |
|
| dc.identifier |
https://hdl.handle.net/10283/2776 |
|
| dc.identifier |
https://doi.org/10.7488/ds/2103 |
|
| dc.identifier.uri |
http://localhost:8080/xmlui/handle/CUHPOERS/244025 |
|
| dc.description |
We use mass spectrometry analysis and molecular modelling to show the established antimicrobial inhibitor 4,5-dichloro-1,2-dithiol-3-one (HR45) acts by forming a covalent adduct with the target β-ketoacyl-ACP synthase III (FabH). The 5-chloro substituent directs attack of the essential active site thiol (C112) via a Michael-type addition elimination reaction mechanism. |
|
| dc.format |
text/csv |
|
| dc.format |
application/zip |
|
| dc.language |
eng |
|
| dc.publisher |
University of Edinburgh. School of Chemistry |
|
| dc.relation |
https://doi.org/10.1039/C7OB01396E |
|
| dc.rights |
Creative Commons Attribution 4.0 International Public License |
|
| dc.subject |
Physical Sciences::Chemistry |
|
| dc.title |
Structural evidence for the covalent modification of FabH by 4,5-dichloro-1,2-dithiol-3-one (HR45) |
|
| dc.type |
dataset |
|
| dc.coverage |
UK |
|
| dc.coverage |
UNITED KINGDOM |
|