Cargando…

Structure of HI-6•Sarin-Acetylcholinesterase Determined by X-Ray Crystallography and Molecular Dynamics Simulation: Reactivator Mechanism and Design

Organophosphonates such as isopropyl metylphosphonofluoridate (sarin) are extremely toxic as they phosphonylate the catalytic serine residue of acetylcholinesterase (AChE), an enzyme essential to humans and other species. Design of effective AChE reactivators as antidotes to various organophosphonat...

Descripción completa

Detalles Bibliográficos
Autores principales:	Ekström, Fredrik, Hörnberg, Andreas, Artursson, Elisabet, Hammarström, Lars-Gunnar, Schneider, Gunter, Pang, Yuan-Ping
Formato:	Texto
Lenguaje:	English
Publicado:	Public Library of Science 2009
Materias:	Research Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2693926/ https://www.ncbi.nlm.nih.gov/pubmed/19536291 http://dx.doi.org/10.1371/journal.pone.0005957

Ejemplares similares

Targeting Acetylcholinesterase: Identification of Chemical Leads by High Throughput Screening, Structure Determination and Molecular Modeling
por: Berg, Lotta, et al.
Publicado: (2011)

Broad‐Spectrum Antidote Discovery by Untangling the Reactivation Mechanism of Nerve‐Agent‐Inhibited Acetylcholinesterase
por: Lindgren, Cecilia, et al.
Publicado: (2022)

X-ray crystallography
por: James, R W
Publicado: (1953)

X-ray crystallography
por: James, R W
Publicado: (1945)

Pivotal role of a conserved histidine in Escherichia coli ribonuclease HI as proposed by X-ray crystallography
por: Liao, Zengwei, et al.
Publicado: (2022)

X-Ray Crystallography of Biomacromolecules
por: Blaho, Dorottya
Publicado: (2008)

X-ray lasers and crystallography
por: Spence, John C.H.
Publicado: (2014)

Structure determination by X-ray crystallography
por: Ladd, M F C, et al.
Publicado: (1977)

Structure determination by X-ray crystallography
por: Ladd, M F C, et al.
Publicado: (1995)

X-ray pixel detector for crystallography
por: Delpierre, P A, et al.
Publicado: (2001)

Early days of X-ray crystallography
por: Authier, André
Publicado: (2013)

X-ray pixel detector for crystallography
por: Delpierre, P A, et al.
Publicado: (2000)

Structure determination by X-ray crystallography
por: Ladd, Mark, et al.
Publicado: (2003)

Structure determination by X-ray crystallography
por: Ladd, M F C, et al.
Publicado: (1993)

Structure determination by X-ray crystallography
por: Ladd, M F C, et al.
Publicado: (1977)

Structure determination by X-ray crystallography
por: Ladd, M F C, et al.
Publicado: (1985)

X-ray lasers and serial crystallography
por: Spence, John C. H.
Publicado: (2015)

X-ray crystallography of TRP channels
por: Singh, Appu K., et al.
Publicado: (2018)

Sarin: a never-ending story
por: Bolt, Hermann M.
Publicado: (2022)

X-Ray diffraction crystallography : introduction, examples and solved problems /
por: Waseda, Yoshio
Publicado: (2011)

Temperature-dependent macromolecular X-ray crystallography
por: Weik, Martin, et al.
Publicado: (2010)

Combining X-ray and neutron crystallography with spectroscopy
por: Kwon, Hanna, et al.
Publicado: (2017)

Serial crystallography at synchrotrons and X-ray lasers
por: Standfuss, Jörg, et al.
Publicado: (2017)

Protein X-ray Crystallography and Drug Discovery
por: Maveyraud, Laurent, et al.
Publicado: (2020)

Combining X-Ray Crystallography and Electron Microscopy
por: Rossmann, Michael G., et al.
Publicado: (2005)

General Strategies for RNA X-ray Crystallography
por: Jackson, Ryland W., et al.
Publicado: (2023)

Sub-atomic resolution X-ray crystallography and neutron crystallography: promise, challenges and potential
por: Blakeley, Matthew P., et al.
Publicado: (2015)

Discovery of Novel Non-Oxime Reactivators Showing In Vivo Antidotal Efficiency for Sarin Poisoned Mice
por: Wei, Zhao, et al.
Publicado: (2022)

Molecular Modeling Study of Uncharged Oximes Compared to HI-6 and 2-PAM Inside Human AChE Sarin and VX Conjugates
por: Souza, Felipe Rodrigues de, et al.
Publicado: (2020)

Effects of sarin on the nervous system in rescue team staff members and police officers 3 years after the Tokyo subway sarin attack.
por: Nishiwaki, Y, et al.
Publicado: (2001)

Developments in low-resolution biological X-ray crystallography
por: Dyda, Fred
Publicado: (2010)

Crystals x-rays and proteins: comprehensive protein crystallography
por: Sherwood, Dennis, et al.
Publicado: (2011)

Protein crystallization: Eluding the bottleneck of X-ray crystallography
por: Holcomb, Joshua, et al.
Publicado: (2017)

Chemical crystallography by serial femtosecond X-ray diffraction
por: Schriber, Elyse A., et al.
Publicado: (2022)

Determining the oxidation state of elements by X-ray crystallography
por: Lennartz, Frank, et al.
Publicado: (2022)

The Tokyo Attacks in Retrospect Sarin Leads to Memory Loss
por: Hood, E
Publicado: (2001)

Social media video analysis methodology for sarin exposure
por: Toprak, Sadik, et al.
Publicado: (2020)

Single-crystal Raman spectroscopy and X-ray crystallography at beamline X26-C of the NSLS
por: Stoner-Ma, Deborah, et al.
Publicado: (2011)

Whole-Transcriptome Analysis of Repeated Low-Level Sarin-Exposed Rat Hippocampus and Identification of Cerna Networks to Investigate the Mechanism of Sarin-Induced Cognitive Impairment
por: Shi, Jingjing, et al.
Publicado: (2023)

The Barium Site in a Potassium Channel by X-Ray Crystallography
por: Jiang, Youxing, et al.
Publicado: (2000)

Cannot write session to /tmp/vufind_sessions/sess_dvfvtsp4fissksvre2ot5toe0i