2a4g

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(New page: 200px<br /><applet load="2a4g" size="350" color="white" frame="true" align="right" spinBox="true" caption="2a4g, resolution 2.50&Aring;" /> '''Hepatitis C Protease...)
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Revision as of 15:54, 29 January 2008


2a4g, resolution 2.50Å

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Hepatitis C Protease NS3-4A serine protease with Ketoamide Inhibitor SCH225724 Bound

Overview

We have discovered that introduction of appropriate amino acid derivatives, at P'2 position improved the binding potency of P3-capped alpha-ketoamide, inhibitors of HCV NS3 serine protease. X-ray crystal structure of one of, the inhibitors (43) bound to the protease revealed the importance of the, P'2 moiety.

About this Structure

2A4G is a Protein complex structure of sequences from Hepatitis c virus with and as ligands. Full crystallographic information is available from OCA.

Reference

Hepatitis C virus NS3-4A serine protease inhibitors: SAR of P'2 moiety with improved potency., Arasappan A, Njoroge FG, Chan TY, Bennett F, Bogen SL, Chen K, Gu H, Hong L, Jao E, Liu YT, Lovey RG, Parekh T, Pike RE, Pinto P, Santhanam B, Venkatraman S, Vaccaro H, Wang H, Yang X, Zhu Z, Mckittrick B, Saksena AK, Girijavallabhan V, Pichardo J, Butkiewicz N, Ingram R, Malcolm B, Prongay A, Yao N, Marten B, Madison V, Kemp S, Levy O, Lim-Wilby M, Tamura S, Ganguly AK, Bioorg Med Chem Lett. 2005 Oct 1;15(19):4180-4. PMID:16087332

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