Molecular dynamic simulations of the human calcitonin receptor extracellular domain with RAMP1

Dataset

Description

These files are the first 10 eigenvectors arising after principle component analysis. An homology model of the extracellular domain of the receptor in complex with the extracellular domain of RAMP1 was generated and the minimised protein was placed centrally in a charge neutral cubic box (x=10nm) consisting of TIP3 water molecules, 150 mM NaCl and simulated for 1µs. The files consist of 99 snapshots. They may be viewed using VMD, available freely from the University of Illinois.

Funding: Maurice Wilkins Centre for Molecular Biodiscovery, Maurice and Phyllis Paykel Trust, University of Auckland doctoral scholarship, National Heart Foundation of New Zealand, National Institute of Health (R01GM104251), Wellcome Trust (091496), National Health and Medical Research Council of Australia (1061044, 1055134)
Date made available21 Jul 2015
PublisherAston Data Explorer
Date of data production2015 -

Research Output

An allosteric role for receptor activity-modifying proteins in defining GPCR pharmacology

Gingell, J. J., Simms, J., Barwell, J., Poyner, D. R., Watkins, H. A., Pioszak, AA., Sexton, P. M. & Hay, D. L., 17 May 2016, In : Cell Discovery. 2, 16012.

Research output: Contribution to journalArticle

Open Access
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  • Cite this

    Poyner, D. (Creator), Simms, J. W. (Creator) (21 Jul 2015). Molecular dynamic simulations of the human calcitonin receptor extracellular domain with RAMP1. Aston Data Explorer. 10.17036/3d96d65d-5c12-42d3-ac48-63d91174b32a