1j4r

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[[Image:1j4r.gif|left|200px]]
[[Image:1j4r.gif|left|200px]]
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{{Structure
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<!--
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|PDB= 1j4r |SIZE=350|CAPTION= <scene name='initialview01'>1j4r</scene>, resolution 1.80&Aring;
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The line below this paragraph, containing "STRUCTURE_1j4r", 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=001:1-[2,2-DIFLUORO-2-(3,4,5-TRIMETHOXY-PHENYL)-ACETYL]-PIPERIDINE-2-CARBOXYLIC+ACID+4-PHENYL-1-(3-PYRIDIN-3-YL-PROPYL)-BUTYL+ESTER'>001</scene>, <scene name='pdbligand=GOL:GLYCEROL'>GOL</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</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= <span class='plainlinks'>[http://en.wikipedia.org/wiki/Peptidylprolyl_isomerase Peptidylprolyl isomerase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=5.2.1.8 5.2.1.8] </span>
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or leave the SCENE parameter empty for the default display.
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|GENE=
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-->
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|DOMAIN=
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{{STRUCTURE_1j4r| PDB=1j4r | SCENE= }}
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|RELATEDENTRY=
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|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=1j4r FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=1j4r OCA], [http://www.ebi.ac.uk/pdbsum/1j4r PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=1j4r RCSB]</span>
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}}
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'''FK506 BINDING PROTEIN COMPLEXED WITH FKB-001'''
'''FK506 BINDING PROTEIN COMPLEXED WITH FKB-001'''
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[[Category: Single protein]]
[[Category: Single protein]]
[[Category: Sheriff, S.]]
[[Category: Sheriff, S.]]
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[[Category: inhibitor]]
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[[Category: Inhibitor]]
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[[Category: rotamase]]
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[[Category: Rotamase]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Fri May 2 20:48:12 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sun Mar 30 21:28:48 2008''
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Revision as of 17:48, 2 May 2008

Image:1j4r.gif

Template:STRUCTURE 1j4r

FK506 BINDING PROTEIN COMPLEXED WITH FKB-001


Overview

[structure: see text] 2-Aryl-2,2-difluoroacetamido-proline and pipecolate esters are high affinity FKBP12 ligands whose rotamase inhibitory activity is comparable to that seen for the corresponding ketoamides. X-ray structural studies suggest that the fluorine atoms participate in discrete interactions with the Phe36 phenyl ring and the Tyr26 hydroxyl group, with the latter resembling a moderate-to-weak hydrogen bond.

About this Structure

1J4R is a Single protein structure of sequence from Homo sapiens. Full crystallographic information is available from OCA.

Reference

2-Aryl-2,2-difluoroacetamide FKBP12 ligands: synthesis and X-ray structural studies., Dubowchik GM, Vrudhula VM, Dasgupta B, Ditta J, Chen T, Sheriff S, Sipman K, Witmer M, Tredup J, Vyas DM, Verdoorn TA, Bollini S, Vinitsky A, Org Lett. 2001 Dec 13;3(25):3987-90. PMID:11735566 Page seeded by OCA on Fri May 2 20:48:12 2008

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