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Table 2 Examination of the original 1A1Z structure and two different perturbations of 1A1Z, each in two alignment media, before and after refinement with XplorGUI

From: Advances in the REDCAT software package

  

    Before refinement

  

    After refinement

 

Starting structure

M1 (Hz)

M2 (Hz)

bb-rmsd(Ã…) to 1A1Z

M1 (Hz)

M2 (Hz)

bb-rmsd(Ã…) to 1A1Z

1A1Z

1.3×10-5

3.9×10-5

0.00

0.0155

0.0153

0.22

1A1Z.PHI

2.38767

2.30944

1.99

0.0160

0.0155

0.23

1A1Z.NAMD

5.86019

4.57652

2.21

0.0352

0.0396

1.36