English
 
Help Privacy Policy Disclaimer
  Advanced SearchBrowse

Item

ITEM ACTIONSEXPORT

Released

Journal Article

Single molecule force spectroscopy data and BD- and MD simulations on the blood protein von Willebrand factor

MPS-Authors
/persons/resource/persons21325

Baldauf,  Carsten
Theory, Fritz Haber Institute, Max Planck Society;

External Resource
No external resources are shared
Fulltext (restricted access)
There are currently no full texts shared for your IP range.
Fulltext (public)

1-s2.0-S235234091630467X-main.pdf
(Publisher version), 2MB

Supplementary Material (public)
There is no public supplementary material available
Citation

Posch, S., Aponte-Santamaría, C., Schwarzl, R., Karner, A., Radtke, M., Gräter, F., et al. (2016). Single molecule force spectroscopy data and BD- and MD simulations on the blood protein von Willebrand factor. Data in Brief, 8, 1080-1087. doi:10.1016/j.dib.2016.07.031.


Cite as: https://hdl.handle.net/11858/00-001M-0000-002B-46EE-2
Abstract
We here give information for a deeper understanding of single molecule force spectroscopy (SMFS) data through the example of the blood protein von Willebrand factor (VWF). It is also shown, how fitting of rupture forces versus loading rate profiles in the molecular dynamics (MD) loading-rate range can be used to demonstrate the qualitative agreement between SMFS and MD simulations. The recently developed model by Bullerjahn, Sturm, and Kroy (BSK) was used for this demonstration. Further, Brownian dynamics (BD) simulations, which can be utilized to estimate the lifetimes of intramolecular VWF interactions under physiological shear, are described. For interpretation and discussion of the methods and data presented here, we would like to directly point the reader to the related research paper, “Mutual A domain interactions in the force sensing protein von Willebrand Factor” (Posch et al., 2016)