Data set for "On the interplay between lipids and asymmetric dynamics of an NBS degenerate ABC transporter"
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下载链接：
https://zenodo.org/record/7541177
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资源简介：
Supplementary data from molecular dynamics simulations performed on different states of bMRP1 (IF apo, IF ATP- and/or LTX-bound, as well as OF ATP-bound states) and embedded in different lipid bilayer membranes (namely POPC, POPE, POPC:POPE (3:1), POPC-Chol (3:1) and POPC:POPE:Chol (2:1:1).
Are included:
- Initial and postMD data
- MD inputs used
- Raw source data used for plot (ABC structural parameters, H-bond and non-covalent analyses, lipid order parameters, and efficiencies from Allopath tool)
- PCA supplementary movies (PC1)
创建时间：
2023-01-21
