2ar8

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|PDB= 2ar8 |SIZE=350|CAPTION= <scene name='initialview01'>2ar8</scene>, resolution 2.200&Aring;
|PDB= 2ar8 |SIZE=350|CAPTION= <scene name='initialview01'>2ar8</scene>, resolution 2.200&Aring;
|SITE=
|SITE=
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|LIGAND= <scene name='pdbligand=CL:CHLORIDE+ION'>CL</scene>, <scene name='pdbligand=CTE:7-CHLOROTRYPTOPHAN'>CTE</scene> and <scene name='pdbligand=FAD:FLAVIN-ADENINE DINUCLEOTIDE'>FAD</scene>
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|LIGAND= <scene name='pdbligand=CL:CHLORIDE+ION'>CL</scene>, <scene name='pdbligand=CTE:7-CHLOROTRYPTOPHAN'>CTE</scene>, <scene name='pdbligand=FAD:FLAVIN-ADENINE+DINUCLEOTIDE'>FAD</scene>
|ACTIVITY=
|ACTIVITY=
|GENE= PrnA ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=294 Pseudomonas fluorescens])
|GENE= PrnA ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=294 Pseudomonas fluorescens])
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|DOMAIN=
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|RELATEDENTRY=[[2apg|2APG]], [[2aqj|2AQJ]]
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|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2ar8 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2ar8 OCA], [http://www.ebi.ac.uk/pdbsum/2ar8 PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=2ar8 RCSB]</span>
}}
}}
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[[Category: SSPF, Scottish Structural Proteomics Facility.]]
[[Category: SSPF, Scottish Structural Proteomics Facility.]]
[[Category: Unversucht, S.]]
[[Category: Unversucht, S.]]
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[[Category: CL]]
 
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[[Category: CTE]]
 
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[[Category: FAD]]
 
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[[Category: flavin-dependent halogenase]]
 
[[Category: helical bundle]]
[[Category: helical bundle]]
[[Category: sandwiched sheet]]
[[Category: sandwiched sheet]]
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[[Category: sspf]]
[[Category: sspf]]
[[Category: structural genomic]]
[[Category: structural genomic]]
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[[Category: tryptophan 7-halogenase]]
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[[Category: tryptophan 7-halogenase,flavin-dependent halogenase]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Mar 20 15:52:55 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 01:56:12 2008''

Revision as of 22:56, 30 March 2008


PDB ID 2ar8

Drag the structure with the mouse to rotate
, resolution 2.200Å
Ligands: , ,
Gene: PrnA (Pseudomonas fluorescens)
Related: 2APG, 2AQJ


Resources: FirstGlance, OCA, PDBsum, RCSB
Coordinates: save as pdb, mmCIF, xml



The structure of tryptophan 7-halogenase (PrnA)suggests a mechanism for regioselective chlorination


Overview

Chlorinated natural products include vancomycin and cryptophycin A. Their biosynthesis involves regioselective chlorination by flavin-dependent halogenases. We report the structural characterization of tryptophan 7-halogenase (PrnA), which regioselectively chlorinates tryptophan. Tryptophan and flavin adenine dinucleotide (FAD) are separated by a 10 angstrom-long tunnel and bound by distinct enzyme modules. The FAD module is conserved in halogenases and is related to flavin-dependent monooxygenases. On the basis of biochemical studies, crystal structures, and by analogy with monooxygenases, we predict that FADH2 reacts with O2 to make peroxyflavin, which is decomposed by Cl-. The resulting HOCl is guided through the tunnel to tryptophan, where it is activated to participate in electrophilic aromatic substitution.

About this Structure

2AR8 is a Single protein structure of sequence from Pseudomonas fluorescens. Full crystallographic information is available from OCA.

Reference

Tryptophan 7-halogenase (PrnA) structure suggests a mechanism for regioselective chlorination., Dong C, Flecks S, Unversucht S, Haupt C, van Pee KH, Naismith JH, Science. 2005 Sep 30;309(5744):2216-9. PMID:16195462

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