Skip to main content
. 2013 Mar 18;288(17):12406–12415. doi: 10.1074/jbc.M113.450643

TABLE 1.

Data collection and refinement statistics for PfEBA-140 RII sialyllactose complex

Values in parentheses are for highest resolution shell.

Data collection
    Space group P21
    Cell dimensions
        a, b, c (Å) 64.95, 76.03, 81.43
        α, β, γ (°) 90.00, 96.93, 90.00
    Resolution (Å) 20-3.0 (3.09-3.0)
    Rmerge 7.8% (65.5%)
    II 14.06 (2.05)
    Completeness (%) 96.2% (97.7%)
    Redundancy 3.00 (3.00)

Refinement
    Resolution (Å) 20.0-3.0
    No. of reflections 15,336
    Rwork/Rfree (%) 21.82/25.48
    No. of atoms
        Protein 5266
        Ligand/ion 42
        Water 22
    B-factors
        Protein 87.18
        Ligand/ion 64.23
        Water 42.74
    r.m.s.d.a
        Bond lengths (Å) 0.001
        Bond angles (°) 0.437
    Ramachandran
        Favored 95.52%
        Allowed 4.48%
        Disallowed 0.00%

a r.m.s.d., root mean square deviation.