1bcd

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[[Image:1bcd.jpg|left|200px]]<br /><applet load="1bcd" size="350" color="white" frame="true" align="right" spinBox="true"
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[[Image:1bcd.jpg|left|200px]]
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caption="1bcd, resolution 1.9&Aring;" />
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'''X-RAY CRYSTALLOGRAPHIC STRUCTURE OF A COMPLEX BETWEEN HUMAN CARBONIC ANHYDRASE II AND A NEW TOPICAL INHIBITOR, TRIFLUOROMETHANE SULPHONAMIDE'''<br />
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{{Structure
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|PDB= 1bcd |SIZE=350|CAPTION= <scene name='initialview01'>1bcd</scene>, resolution 1.9&Aring;
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|SITE=
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|LIGAND= <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene> and <scene name='pdbligand=FMS:TRIFLUOROMETHANE SULFONAMIDE'>FMS</scene>
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|ACTIVITY= [http://en.wikipedia.org/wiki/Carbonate_dehydratase Carbonate dehydratase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=4.2.1.1 4.2.1.1]
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|GENE=
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}}
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'''X-RAY CRYSTALLOGRAPHIC STRUCTURE OF A COMPLEX BETWEEN HUMAN CARBONIC ANHYDRASE II AND A NEW TOPICAL INHIBITOR, TRIFLUOROMETHANE SULPHONAMIDE'''
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==Overview==
==Overview==
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==About this Structure==
==About this Structure==
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1BCD is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens] with <scene name='pdbligand=ZN:'>ZN</scene> and <scene name='pdbligand=FMS:'>FMS</scene> as [http://en.wikipedia.org/wiki/ligands ligands]. Active as [http://en.wikipedia.org/wiki/Carbonate_dehydratase Carbonate dehydratase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=4.2.1.1 4.2.1.1] Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1BCD OCA].
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1BCD is a [[Single protein]] structure of sequence from [http://en.wikipedia.org/wiki/Homo_sapiens Homo sapiens]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1BCD OCA].
==Reference==
==Reference==
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The structure of a complex between carbonic anhydrase II and a new inhibitor, trifluoromethane sulphonamide., Hakansson K, Liljas A, FEBS Lett. 1994 Aug 22;350(2-3):319-22. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=8070585 8070585]
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The structure of a complex between carbonic anhydrase II and a new inhibitor, trifluoromethane sulphonamide., Hakansson K, Liljas A, FEBS Lett. 1994 Aug 22;350(2-3):319-22. PMID:[http://www.ncbi.nlm.nih.gov/pubmed/8070585 8070585]
[[Category: Carbonate dehydratase]]
[[Category: Carbonate dehydratase]]
[[Category: Homo sapiens]]
[[Category: Homo sapiens]]
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[[Category: lyase(oxo-acid)]]
[[Category: lyase(oxo-acid)]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 11:53:46 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Mar 20 10:09:08 2008''

Revision as of 08:09, 20 March 2008


PDB ID 1bcd

Drag the structure with the mouse to rotate
, resolution 1.9Å
Ligands: and
Activity: Carbonate dehydratase, with EC number 4.2.1.1
Coordinates: save as pdb, mmCIF, xml



X-RAY CRYSTALLOGRAPHIC STRUCTURE OF A COMPLEX BETWEEN HUMAN CARBONIC ANHYDRASE II AND A NEW TOPICAL INHIBITOR, TRIFLUOROMETHANE SULPHONAMIDE


Contents

Overview

It has recently been shown that aliphatic sulphonamides are good inhibitors of carbonic anhydrase (CA) provided that the pK of the sulphonamide is low. We have determined the structure of the complex between CAII and CF3SO2NH2 by X-ray crystallographic methods. The nitrogen of the sulphonamide is bound to the zinc ion of the enzyme in the usual manner. The other parts of the inhibitor show a different mode of binding from aromatic sulphonamides since the trifluoromethyl group is bound at the hydrophobic part of the active site instead of pointing out from the active site. It should be possible to design new inhibitors specific for the different isoenzymes, starting from the present structure.

Disease

Known disease associated with this structure: Osteopetrosis, autosomal recessive 3, with renal tubular acidosis OMIM:[611492]

About this Structure

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

Reference

The structure of a complex between carbonic anhydrase II and a new inhibitor, trifluoromethane sulphonamide., Hakansson K, Liljas A, FEBS Lett. 1994 Aug 22;350(2-3):319-22. PMID:8070585

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