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2hwh

From Proteopedia

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[[Image:2hwh.gif|left|200px]]
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{{Seed}}
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{{STRUCTURE_2hwh| PDB=2hwh | SCENE= }}
{{STRUCTURE_2hwh| PDB=2hwh | SCENE= }}
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'''HCV NS5B allosteric inhibitor complex'''
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===HCV NS5B allosteric inhibitor complex===
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==Overview==
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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.
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(as it appears on PubMed at http://www.pubmed.gov), where 16934455 is the PubMed ID number.
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{{ABSTRACT_PUBMED_16934455}}
==About this Structure==
==About this Structure==
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[[Category: Rdrp]]
[[Category: Rdrp]]
[[Category: Viral rna-directed rna polymerase]]
[[Category: Viral rna-directed rna polymerase]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sun May 4 06:47:55 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Jul 28 00:30:39 2008''

Revision as of 21:30, 27 July 2008

Template:STRUCTURE 2hwh

HCV NS5B allosteric inhibitor complex

Template:ABSTRACT PUBMED 16934455

About this Structure

2HWH is a Single protein structure of sequence from Hepatitis c virus. Full crystallographic information is available from OCA.

Reference

Structure-based design of a novel thiazolone scaffold as HCV NS5B polymerase allosteric inhibitors., Yan S, Appleby T, Larson G, Wu JZ, Hamatake R, Hong Z, Yao N, Bioorg Med Chem Lett. 2006 Nov 15;16(22):5888-91. Epub 2006 Aug 24. PMID:16934455

Page seeded by OCA on Mon Jul 28 00:30:39 2008

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