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TitleStereo- and Regioselective Azide/Alkyne Cycloadditions in Carbonic Anhydrase II via Tethering, Monitored by Crystallography and Mass Spectrometry.
Journal, issue, pagesChemistry, Vol. 17, Page 5842-5851, Year 2011
Publish dateNov 2, 2009 (structure data deposition date)
AuthorsSchulze Wischeler, J. / Sun, D. / Sandner, N.U. / Linne, U. / Heine, A. / Koert, U. / Klebe, G.
External linksChemistry / PubMed:21506176
MethodsX-ray diffraction
Resolution1.35 - 1.39 Å
Structure data

PDB-3kig:
Mutant carbonic anhydrase II in complex with an azide and an alkyne
Method: X-RAY DIFFRACTION / Resolution: 1.39 Å

PDB-3kne:
Carbonic Anhydrase II H64C mutant in complex with an in situ formed triazole
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-DA9:
2-azido-N-(2-sulfanylethyl)ethanamide

ChemComp-DA4:
3-ethynylbenzenesulfonamide

ChemComp-HOH:
WATER

ChemComp-BE7:
(4-CARBOXYPHENYL)(CHLORO)MERCURY / protease inhibitor*YM

ChemComp-DAW:
N-[(S)-(1-{2-oxo-2-[(3-sulfanylpropyl)amino]ethyl}-1H-1,2,3-triazol-5-yl)(phenyl)methyl]-4-sulfamoylbenzamide

Source
  • homo sapiens (human)
KeywordsLYASE / 10 STRANDED / TWISTED BETA-SHEETS / Disease mutation / Metal-binding / 10 STRANDED; TWISTED BETA-SHEETS; LYASE; Acetylation / click-chemistry / azide / alkyne

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