Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
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Structure of HI-6*sarin-acetylcholinesterase determined by X-ray crystallography and molecular dynamics simulation: reactivator mechanism and designThe morph server: a standardized system for analyzing and visualizing macromolecular motions in a database framework.A database of macromolecular motionsStructure of betaine aldehyde dehydrogenase at 2.1 A resolutionMolecular dynamics simulations suggest that electrostatic funnel directs binding of Tamiflu to influenza N1 neuraminidases.Freeze-frame inhibitor captures acetylcholinesterase in a unique conformationShoot-and-Trap: Use of specific x-ray damage to study structural protein dynamics by temperature-controlled cryo-crystallographyBackdoor opening mechanism in acetylcholinesterase based on X-ray crystallography and molecular dynamics simulationsKinetics of Torpedo californica acetylcholinesterase inhibition by bisnorcymserine and crystal structure of the complex with its leaving groupMolecular characterization of monoclonal antibodies that inhibit acetylcholinesterase by targeting the peripheral site and backdoor regionA conformational change in the peripheral anionic site of Torpedo californica acetylcholinesterase induced by a bis-imidazolium oximeMOLE 2.0: advanced approach for analysis of biomacromolecular channelsCrystal structure of mouse acetylcholinesterase. A peripheral site-occluding loop in a tetrameric assemblyMolecular dynamics simulations of arachidonic acid complexes with COX-1 and COX-2: insights into equilibrium behaviorA wrench in the works of human acetylcholinesterase: soman induced conformational changes revealed by molecular dynamics simulationsEnsemble-based virtual screening reveals potential novel antiviral compounds for avian influenza neuraminidase.Mining electron density for functionally relevant protein polysterism in crystal structures.Gorge Motions of Acetylcholinesterase Revealed by Microsecond Molecular Dynamics Simulations.Protein complex formation by acetylcholinesterase and the neurotoxin fasciculin-2 appears to involve an induced-fit mechanism.Gated Diffusion-controlled ReactionsMutagenesis of phospholipase D defines a superfamily including a trans-Golgi viral protein required for poxvirus pathogenicity.Stability and dynamics of G-actin: back-door water diffusion and behavior of a subdomain 3/4 loopAcetylcholinesterase: diffusional encounter rate constants for dumbbell models of ligandStructural studies of myosin:nucleotide complexes: a revised model for the molecular basis of muscle contraction.Is myosin a "back door" enzyme?Analysis of a 10-ns molecular dynamics simulation of mouse acetylcholinesterase.The dynamics of ligand barrier crossing inside the acetylcholinesterase gorgeMolecular dynamics analysis of structural factors influencing back door pi release in myosinLong route or shortcut? A molecular dynamics study of traffic of thiocholine within the active-site gorge of acetylcholinesteraseCrystal structure of snake venom acetylcholinesterase in complex with inhibitory antibody fragment Fab410 bound at the peripheral site: evidence for open and closed states of a back door channel.Electrostatic potential distribution of the gene V protein from Ff phage facilitates cooperative DNA binding: a model of the GVP-ssDNA complex.Backbone makes a significant contribution to the electrostatics of alpha/beta-barrel proteins.Calculated electrostatic gradients in recombinant human H-chain ferritinDesign of fast enzymes by optimizing interaction potential in active site.Flexibility of aromatic residues in the active-site gorge of acetylcholinesterase: X-ray versus molecular dynamics.Finding and characterizing tunnels in macromolecules with application to ion channels and pores.Decline in serum cholinesterase activities predicts 2-year major adverse cardiac events.The gates of ion channels and enzymes.Molecular basis for the behavioral effects of the odorant degrading enzyme Esterase 6 in Drosophila.Structural and dynamic properties of water around acetylcholinesterase.
P2860
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P2860
Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
description
1994 nî lūn-bûn
@nan
1994年の論文
@ja
1994年学术文章
@wuu
1994年学术文章
@zh
1994年学术文章
@zh-cn
1994年学术文章
@zh-hans
1994年学术文章
@zh-my
1994年学术文章
@zh-sg
1994年學術文章
@yue
1994年學術文章
@zh-hant
name
Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
@en
Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
@nl
type
label
Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
@en
Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
@nl
prefLabel
Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
@en
Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
@nl
P2093
P356
P1433
P1476
Open "back door" in a molecular dynamics simulation of acetylcholinesterase.
@en
P2093
Axelsen PH
Faerman CH
McCammon JA
Straatsma TP
Sussman JL
P304
P356
10.1126/SCIENCE.8122110
P407
P577
1994-03-01T00:00:00Z