1mui

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{{STRUCTURE_1mui| PDB=1mui | SCENE= }}
{{STRUCTURE_1mui| PDB=1mui | SCENE= }}
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'''Crystal structure of HIV-1 protease complexed with Lopinavir.'''
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===Crystal structure of HIV-1 protease complexed with Lopinavir.===
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==Overview==
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The crystal structure of ABT-378 (lopinavir), bound to the active site of HIV-1 protease is described. A comparison with crystal structures of ritonavir, A-78791, and BILA-2450 shows some analogous features with previous reported compounds. A cyclic urea unit in the P(2) position of ABT-378 is novel and makes two bidentate hydrogen bonds with Asp 29 of HIV-1 protease. In addition, a previously unreported shift in the Gly 48 carbonyl position is observed. A discussion of the structural features responsible for its high potency against wild-type HIV protease is given along with an analysis of the effect of active site mutations on potency in in vitro assays.
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(as it appears on PubMed at http://www.pubmed.gov), where 12057670 is the PubMed ID number.
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{{ABSTRACT_PUBMED_12057670}}
==About this Structure==
==About this Structure==
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[[Category: Walter, K.]]
[[Category: Walter, K.]]
[[Category: Hydrolase]]
[[Category: Hydrolase]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sat May 3 01:44:02 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Jul 28 06:58:35 2008''

Revision as of 03:58, 28 July 2008

Image:1mui.png

Template:STRUCTURE 1mui

Crystal structure of HIV-1 protease complexed with Lopinavir.

Template:ABSTRACT PUBMED 12057670

About this Structure

1MUI is a Single protein structure of sequence from Human immunodeficiency virus 1. Full crystallographic information is available from OCA.

Reference

X-ray crystallographic structure of ABT-378 (lopinavir) bound to HIV-1 protease., Stoll V, Qin W, Stewart KD, Jakob C, Park C, Walter K, Simmer RL, Helfrich R, Bussiere D, Kao J, Kempf D, Sham HL, Norbeck DW, Bioorg Med Chem. 2002 Aug;10(8):2803-6. PMID:12057670

Page seeded by OCA on Mon Jul 28 06:58:35 2008

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