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Table 3 RMS deviations between average structures

From: Knottin cyclization: impact on structure and dynamics

  

NMR

MD

X-ray

  

MCoTI-II

lin-MCoTI

EETI-II

MCoTI-II

lin-MCoTI

EETI-II

EETI-II

NMR

MCoTI-II

-

0.52

0.69

0.65

0.61

0.85

0.62

 

lin-MCoTI

0.78

-

0.62

0.81

0.70

0.77

0.61

 

EETI-II

0.87

0.69

-

0.93

0.87

0.81

0.54

MD

MCoTI-II

1.02

0.95

1.15

-

0.67

0.84

0.71

 

lin-MCoTI

0.95

0.79

1.06

0.80

-

0.48

0.64

 

EETI-II

1.14

0.83

1.08

0.89

0.59

-

0.52

X-ray

EETI-II

0.90

0.68

0.74

0.72

0.71

0.61

-

  1. Values in Å for superimposition of backbone atoms of residues 15–33 (above diagonal) and 8–33 (below diagonal).