Author: Leili Zhang; David R. Bell; Binquan Luan; Ruhong Zhou
Title: Exploring the Binding Mechanism between Human Profilin (PFN1) and Polyproline-10 through Binding Mode Screening Document date: 2018_9_16
ID: 40pe21lm_65
Snippet: in Table S1 . Binding mechanism of mode11 in Figure S1 . Aromatic-proline stacking index measurements for umbrella sampling in Figure S2 . RMSD of PFN, P10 and the whole complex from MD simulations in Figure S3 . Initial binding interface and final binding interface from MD simulations in Figure S4 . Correlation between MD simulation results and PMF differences in Figure S5 . SMD work curves of PFN-P10 in Figure S6 , Figure S7 . Correlation coeff.....
Document: in Table S1 . Binding mechanism of mode11 in Figure S1 . Aromatic-proline stacking index measurements for umbrella sampling in Figure S2 . RMSD of PFN, P10 and the whole complex from MD simulations in Figure S3 . Initial binding interface and final binding interface from MD simulations in Figure S4 . Correlation between MD simulation results and PMF differences in Figure S5 . SMD work curves of PFN-P10 in Figure S6 , Figure S7 . Correlation coefficient analyses versus number of trials in Figure S8 . Rank order correlations in Figure S9 . All rights reserved. No reuse allowed without permission.
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