Steered MD simulations of the inactive-active transition

Description

This protocol details steered molecular dynamics simulations of the transition from the inactive to the active PI3KC3-C1 complex bound to RAB1A on a lipid membrane.

Identifier (DOI)

10.17504/protocols.io.eq2ly68drgx9/v1

Tags

Molecular Dynamics simulation (MD)
Other
PI3KC3-C1 complex
Rab GTPases

Team

Team Hurley

Program

Collaborative Research Network

Theme

PD Functional Genomics

Meet the Authors

Ainara Claveras Cabezudo, MSc

Key Personnel: Team Hurley,

Max Planck Institute of Biophysics
Annan (Zeke) Cook, BSc

Key Personnel: Team Hurley,

University of California, Berkeley

Steered MD simulations of the inactive-active transition

Output Details

Meet the Authors

Ainara Claveras Cabezudo, MSc

Annan (Zeke) Cook, BSc

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Molecular Dynamics Simulations of Active, Membrane-Engaged Complex