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Structure paper

TitleA conformational change in the peripheral anionic site of Torpedo californica acetylcholinesterase induced by a bis-imidazolium oxime.
Journal, issue, pagesActa Crystallogr. ,Sect. D, Vol. 71, Page 1788-1798, Year 2015
Publish dateJun 7, 2015 (structure data deposition date)
AuthorsLegler, P.M. / Soojhawon, I. / Millard, C.B.
External linksActa Crystallogr. ,Sect. D / PubMed:26327369
MethodsX-ray diffraction
Resolution2.45 - 2.57 Å
Structure data

PDB-5bwb:
ACETYLCHOLINESTERASE (E.C. 3.1.1.7) FROM TORPEDO CALIFORNICA IN COMPLEX WITH THE BIS-IMIDAZOLIUM OXIME 2BIM-7
Method: X-RAY DIFFRACTION / Resolution: 2.57 Å

PDB-5bwc:
ACETYLCHOLINESTERASE (E.C. 3.1.1.7) FROM TORPEDO CALIFORNICA IN COMPLEX WITH THE BIS-PYRIDINIUM OXIME ORTHO-7
Method: X-RAY DIFFRACTION / Resolution: 2.45 Å

Chemicals

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-MES:
2-(N-MORPHOLINO)-ETHANESULFONIC ACID / pH buffer*YM

ChemComp-4VV:
(Z,Z)-[heptane-1,7-diylbis(1H-imidazol-1-yl-2-ylidene)]bis(N-hydroxymethanamine)

ChemComp-HOH:
WATER

ChemComp-HBP:
1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME

Source
  • torpedo californica (Pacific electric ray)
KeywordsHydrolase/Hydrolase inhibitor / Acetylcholinesterase / Hydrolase-Hydrolase inhibitor complex

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