2hwi: Difference between revisions
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New page: left|200px<br /><applet load="2hwi" size="350" color="white" frame="true" align="right" spinBox="true" caption="2hwi, resolution 2.0Å" /> '''HCV NS5B allosteric i... |
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==Overview== | ==Overview== | ||
A structure-based approach was performed to design a novel thiazolone | A structure-based approach was performed to design a novel thiazolone scaffold as HCV NS5B inhibitors. A focused library was designed and docked by GOLD. One of the top-scored molecules was synthesized and shown to have similar potency to the initial hit. The X-ray complex structure was determined and validated our design rationale. | ||
==About this Structure== | ==About this Structure== | ||
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[[Category: viral rna-directed rna polymerase]] | [[Category: viral rna-directed rna polymerase]] | ||
''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on | ''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 17:46:30 2008'' | ||
