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. Author manuscript; available in PMC: 2012 Dec 10.
Published in final edited form as: Biochem J. 2010 Feb 24;426(3):281–292. doi: 10.1042/BJ20091351

Table 1. Data collection and refinement statistics.

Values in parentheses refer to the highest resolution shell. Ramachandran plot statistics were determined with PROCHECK [25].

Parameter LplGT HgCl2 derivative LplGT and UDP-glucose LppGT, UDP and glucose
Space group H 3 H 3 P 21
Wavelength (Å) 1.003 1.282 1.892
Resolution (Å) 20.0-2.10 20.0-1.9 20.0-2.1
Cell dimensions a = 0122.3Å
b = 0122.3Å
c = 103.1Å
a = 0122.8Å
b = 0122.8
c = 103.4Å,
a = 051.0Å
b = 0104.6Å
c = 53.3Å
Unique reflections 33622 45918 31842
Completeness 0.999 (0.991) 0.992 (0.969) 0.971 (0.918)
Rsym 0.099 (0.520) 0.073 (0.50) 0.125 (0.402)
I/σ(I) 26.0 (5.7) 29 (5.8) 23.2 (5.5)
Redundancy 12.8 (11.8) 10.3 (7.2) 6.5 (3.6)
Rwork/Rfree 0.199/0.261 0.189/0.254
RMSD from ideal geometry, bonds (Å) 0.012 0.008
RMSD from ideal geometry, angles (°) 1.4 1.2
B-factor (backbone bonds) RMSD (Å2) 0.74 0.56
B-factor protein (Å2) 35.4 27.3
B-factor UDP-glucose (Å2) 29.4
B-factor UDP (Å2) 19.4
B-factor glucose (Å2) 26.9
B-factor solvent (Å2) 40.6 33.5
Ramachandran plot:
 Most favoured (%) 97.7 96.2
 Additionally allowed (%) 2.3 2.9
 Generously allowed (%) 0.0 0.21
PDB code 2WZG 2WZF