2hb1

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[[Image:2hb1.gif|left|200px]]
[[Image:2hb1.gif|left|200px]]
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{{Structure
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|PDB= 2hb1 |SIZE=350|CAPTION= <scene name='initialview01'>2hb1</scene>, resolution 2.0&Aring;
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The line below this paragraph, containing "STRUCTURE_2hb1", creates the "Structure Box" on the page.
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|SITE=
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You may change the PDB parameter (which sets the PDB file loaded into the applet)
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|LIGAND= <scene name='pdbligand=512:4-BROMO-3-(CARBOXYMETHOXY)THIOPHENE-2-CARBOXYLIC+ACID'>512</scene>
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or the SCENE parameter (which sets the initial scene displayed when the page is loaded),
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|ACTIVITY=
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|GENE= PTPN1, PTP1B ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 Homo sapiens])
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|DOMAIN=
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{{STRUCTURE_2hb1| PDB=2hb1 | SCENE= }}
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|RELATEDENTRY=[[2h4g|2H4G]], [[2h4k|2H4K]]
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|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2hb1 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2hb1 OCA], [http://www.ebi.ac.uk/pdbsum/2hb1 PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=2hb1 RCSB]</span>
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'''Crystal Structure of PTP1B with Monocyclic Thiophene Inhibitor'''
'''Crystal Structure of PTP1B with Monocyclic Thiophene Inhibitor'''
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[[Category: Wan, Z K.]]
[[Category: Wan, Z K.]]
[[Category: Xu, W.]]
[[Category: Xu, W.]]
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[[Category: protein-inhibitor complex]]
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[[Category: Protein-inhibitor complex]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sun May 4 06:04:32 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 03:27:58 2008''
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Revision as of 03:04, 4 May 2008

Image:2hb1.gif

Template:STRUCTURE 2hb1

Crystal Structure of PTP1B with Monocyclic Thiophene Inhibitor


Overview

A series of monocyclic thiophenes was designed and synthesized as PTP1B inhibitors. Guided by X-ray co-crystal structural information and computational modeling, rational design led to key interactions with Asp48 and improved inhibitory potency against PTP1B.

About this Structure

2HB1 is a Single protein structure of sequence from Homo sapiens. Full crystallographic information is available from OCA.

Reference

Monocyclic thiophenes as protein tyrosine phosphatase 1B inhibitors: capturing interactions with Asp48., Wan ZK, Lee J, Xu W, Erbe DV, Joseph-McCarthy D, Follows BC, Zhang YL, Bioorg Med Chem Lett. 2006 Sep 15;16(18):4941-5. Epub 2006 Jun 27. PMID:16806920 Page seeded by OCA on Sun May 4 06:04:32 2008

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OCA

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