1fzz
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(New page: 200px<br /><applet load="1fzz" size="450" color="white" frame="true" align="right" spinBox="true" caption="1fzz, resolution 1.86Å" /> '''THE CRYSTAL STRUCTUR...)
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Revision as of 13:26, 20 November 2007
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THE CRYSTAL STRUCTURE OF THE COMPLEX OF NON-PEPTIDIC INHIBITOR ONO-6818 AND PORCINE PANCREATIC ELASTASE.
Overview
The crystal structure of a new inhibitor of human neutrophil elastase, (HNE), N-[2-[5-(tert-butyl)-1,3,4-oxadiazol-2-yl]-(IRS)-1-(methylethyl)-2-oxoethy, l]-2-(5-amino-6-oxo-2-phenyl-6H-pyrimidin-1-ly)acetamide (ONO-6818, 1), complexed to porcine pancreatic elastase (PPE) has been determined at 1.86, A resolution. Analytical results provided evidence of a 1:1 complex in, which the electrophilic ketone of 1 covalently bound to O gamma of Ser195, at the active site of PPE. The role of the unique electron-withdrawing, ketone of 1 has been elucidated.
About this Structure
1FZZ is a Single protein structure of sequence from Sus scrofa with 681 as ligand. Active as Pancreatic elastase, with EC number 3.4.21.36 Full crystallographic information is available from OCA.
Reference
The crystal structure of the complex of non-peptidic inhibitor of human neutrophil elastase ONO-6818 and porcine pancreatic elastase., Odagaki Y, Ohmoto K, Matsuoka S, Hamanaka N, Nakai H, Toda M, Katsuya Y, Bioorg Med Chem. 2001 Mar;9(3):647-51. PMID:11310599
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