4cq0

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<StructureSection load='4cq0' size='340' side='right' caption='[[4cq0]], [[Resolution|resolution]] 1.45&Aring;' scene=''>
<StructureSection load='4cq0' size='340' side='right' caption='[[4cq0]], [[Resolution|resolution]] 1.45&Aring;' scene=''>
== Structural highlights ==
== Structural highlights ==
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<table><tr><td colspan='2'>[[4cq0]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Human Human]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4CQ0 OCA]. <br>
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<table><tr><td colspan='2'>[[4cq0]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Human Human]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4CQ0 OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4CQ0 FirstGlance]. <br>
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</td></tr><tr><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=FMT:FORMIC+ACID'>FMT</scene>, <scene name='pdbligand=SXS:6-AMINO-1,2-BENZOTHIAZOL-3(2H)-ONE+1,1-DIOXIDE'>SXS</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene><br>
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</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=FMT:FORMIC+ACID'>FMT</scene>, <scene name='pdbligand=SXS:6-AMINO-1,2-BENZOTHIAZOL-3(2H)-ONE+1,1-DIOXIDE'>SXS</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>
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<tr><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Glucokinase Glucokinase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=2.7.1.2 2.7.1.2] </span></td></tr>
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<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[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] </span></td></tr>
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<tr><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4cq0 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4cq0 OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4cq0 RCSB], [http://www.ebi.ac.uk/pdbsum/4cq0 PDBsum]</span></td></tr>
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<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=4cq0 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4cq0 OCA], [http://www.rcsb.org/pdb/explore.do?structureId=4cq0 RCSB], [http://www.ebi.ac.uk/pdbsum/4cq0 PDBsum]</span></td></tr>
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<table>
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</table>
== Disease ==
== Disease ==
[[http://www.uniprot.org/uniprot/CAH2_HUMAN CAH2_HUMAN]] Defects in CA2 are the cause of osteopetrosis autosomal recessive type 3 (OPTB3) [MIM:[http://omim.org/entry/259730 259730]]; also known as osteopetrosis with renal tubular acidosis, carbonic anhydrase II deficiency syndrome, Guibaud-Vainsel syndrome or marble brain disease. Osteopetrosis is a rare genetic disease characterized by abnormally dense bone, due to defective resorption of immature bone. The disorder occurs in two forms: a severe autosomal recessive form occurring in utero, infancy, or childhood, and a benign autosomal dominant form occurring in adolescence or adulthood. Autosomal recessive osteopetrosis is usually associated with normal or elevated amount of non-functional osteoclasts. OPTB3 is associated with renal tubular acidosis, cerebral calcification (marble brain disease) and in some cases with mental retardation.<ref>PMID:1928091</ref> <ref>PMID:1542674</ref> <ref>PMID:8834238</ref> <ref>PMID:9143915</ref> <ref>PMID:15300855</ref>
[[http://www.uniprot.org/uniprot/CAH2_HUMAN CAH2_HUMAN]] Defects in CA2 are the cause of osteopetrosis autosomal recessive type 3 (OPTB3) [MIM:[http://omim.org/entry/259730 259730]]; also known as osteopetrosis with renal tubular acidosis, carbonic anhydrase II deficiency syndrome, Guibaud-Vainsel syndrome or marble brain disease. Osteopetrosis is a rare genetic disease characterized by abnormally dense bone, due to defective resorption of immature bone. The disorder occurs in two forms: a severe autosomal recessive form occurring in utero, infancy, or childhood, and a benign autosomal dominant form occurring in adolescence or adulthood. Autosomal recessive osteopetrosis is usually associated with normal or elevated amount of non-functional osteoclasts. OPTB3 is associated with renal tubular acidosis, cerebral calcification (marble brain disease) and in some cases with mental retardation.<ref>PMID:1928091</ref> <ref>PMID:1542674</ref> <ref>PMID:8834238</ref> <ref>PMID:9143915</ref> <ref>PMID:15300855</ref>
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Cyclic Secondary Sulfonamides: Unusually Good Inhibitors of Cancer-Related Carbonic Anhydrase Enzymes.,Moeker J, Peat TS, Bornaghi LF, Vullo D, Supuran CT, Poulsen SA J Med Chem. 2014 Apr 11. PMID:24689792<ref>PMID:24689792</ref>
Cyclic Secondary Sulfonamides: Unusually Good Inhibitors of Cancer-Related Carbonic Anhydrase Enzymes.,Moeker J, Peat TS, Bornaghi LF, Vullo D, Supuran CT, Poulsen SA J Med Chem. 2014 Apr 11. PMID:24689792<ref>PMID:24689792</ref>
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From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br>
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From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
</div>
</div>
== References ==
== References ==
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[[Category: Carbonate dehydratase]]
[[Category: Carbonate dehydratase]]
[[Category: Human]]
[[Category: Human]]
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[[Category: Bornaghi, L F.]]
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[[Category: Bornaghi, L F]]
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[[Category: Moeker, J.]]
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[[Category: Moeker, J]]
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[[Category: Peat, T S.]]
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[[Category: Peat, T S]]
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[[Category: Poulsen, S.]]
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[[Category: Poulsen, S]]
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[[Category: Supuran, C T.]]
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[[Category: Supuran, C T]]
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[[Category: Vullo, D.]]
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[[Category: Vullo, D]]
[[Category: Click chemistry]]
[[Category: Click chemistry]]
[[Category: Drug design]]
[[Category: Drug design]]
[[Category: Lyase]]
[[Category: Lyase]]
[[Category: Saccharin]]
[[Category: Saccharin]]

Revision as of 14:09, 4 January 2015

Cyclic secondary sulfonamides: unusually good inhibitors of cancer- related carbonic anhydrase enzymes

4cq0, resolution 1.45Å

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