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. Author manuscript; available in PMC: 2010 Apr 7.
Published in final edited form as: J Struct Funct Genomics. 2008 Dec 20;10(2):127–136. doi: 10.1007/s10969-008-9054-7

Table 3.

Comparison of NMR (2K07) and X-ray (3E2G and 2Z6Pd) Ufcl structures (r.m.s.d. values in [Å])

Atoms selected for r.m.s.d. calculationa 2K07 vs 3EVX 2K07 vs 2Z6Pd 3EVX vs 2Z6Pd
Backbone heavy atoms N, Cα, C’ of regular secondary structure elementsb 1.13 1.12 1.09
All heavy atoms of regular secondary structure elements 1.86 1.65 1.77
Backbone heavy atoms of regular secondary structure elementsb except for α1 0.90 0.76 0.56
All heavy atoms of regular secondary structure elements except for αl 1.63 1.43 1.38
Backbone heavy atoms N, Cα, C’ of residues 5-159 1.29 1.25 0.91
All heavy atoms of residues 5-159 1.89 1.78 1.61
All heavy atoms of best-defined side chainsc 1.09 1.03 0.83
a

Pair-wise r.m.s.d. values calculated between the mean NMR coordinates and the X-ray structures.

b

Residues are given in Table 1.

c

Residues are given in Table 1.

d

Study of Mizushima et al. [28].