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. 2006 Oct 25;62(Pt 11):1076–1081. doi: 10.1107/S1744309106041790

Table 1. Crystallographic statistics.

The X-ray data were processed using HKL-2000 (Otwinowski & Minor, 2001). Values in parentheses are for the highest resolution bin.

PDB code 2i5d
Space group P21212
Unit-cell parameters (Å) a = 31.1, b = 105.0, c = 49.9
Z (No. of molecules per ASU) 1
VM3 Da−1) 1.89
Solvent content (%) 34.96
Resolution range (Å) 105–1.63 (1.69–1.63)
No. of observed/unique reflections 123793/20838
Completeness (%) 98.1 (98.2)
Multiplicity 5.9 (5.3)
Rsym (%) 4.8 (44.2)
I/σ(I) 35.7 (3.3)
Rcryst 19.0
Rfree§ 24.0
No. of atoms 1888
No. of water atoms 228
R.m.s.d. bonds (Å) 0.013
R.m.s.d. angles (°) 1.39
Ramachandran analysis (%)  
 Residues in most favorable region 98.2
 Residues in allowed regions 1.2
 Residues in disallowed regions 0.6
Average B2) 20.8

Solvent content was calculated based on the Matthews method (Matthews, 1968).

R sym = Inline graphic Inline graphic.

§

The R free test set size was 5% (Brünger, 1993).

Ramachandran analysis was performed with PROCHECK (Laskowski et al., 1993).