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TitleA Second Look at the Crystal Structures ofDrosophila melanogasterAcetylcholinesterase in Complex with Tacrine Derivatives Provides Insights Concerning Catalytic Intermediates and the Design of Specific Insecticides.
Journal, issue, pagesMolecules, Vol. 25, Year 2020
Publish dateJan 31, 2020 (structure data deposition date)
AuthorsNachon, F. / Rosenberry, T.L. / Silman, I. / Sussman, J.L.
External linksMolecules / PubMed:32155891
MethodsX-ray diffraction
Resolution2.46 - 2.7 Å
Structure data

PDB-6xys:
Update of native acetylcholinesterase from Drosophila Melanogaster
Method: X-RAY DIFFRACTION / Resolution: 2.46 Å

PDB-6xyu:
Update of AChE from Drosophila Melanogaster complex with tacrine derivative 9-(3-iodobenzylamino)-1,2,3,4-tetrahydroacridine
Method: X-RAY DIFFRACTION / Resolution: 2.51 Å

PDB-6xyy:
Update of ACHE FROM DROSOPHILA MELANOGASTER COMPLEX WITH TACRINE DERIVATIVE 9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE
Method: X-RAY DIFFRACTION / Resolution: 2.7 Å

Chemicals

ChemComp-CL:
Unknown entry

ChemComp-ACT:
ACETATE ION

ChemComp-HOH:
WATER

ChemComp-I40:
9-(3-IODOBENZYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE

ChemComp-IOD:
IODIDE ION

ChemComp-PPI:
PROPANOIC ACID

ChemComp-760:
9-(3-PHENYLMETHYLAMINO)-1,2,3,4-TETRAHYDROACRIDINE

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

ChemComp-SO4:
SULFATE ION

Source
  • drosophila melanogaster (fruit fly)
KeywordsHYDROLASE / acetylcholinesterase / insect / catalytic / intermediates / inhibitor / complex

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