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. 2007 Nov 13;104(47):18445–18450. doi: 10.1073/pnas.0706784104

Table 1.

Crystallographic and refinement data

Parameter Crystal
α3β1γ:GDP-Mg2+ α3βγ:GDP-Pi
Data collection wavelength, Å 0.9795 1.007
X-ray source id14eh4 id23eh1
Space group C2 P3221
Cell parameters
    a/b/c, Å 122.1/51.8/98.0 118.6/118.6/160.9
    β, ° 94.4
Unique reflections 31,835 21,823
Resolution, Å 2.15 3.2
Completeness, % 95.3 98.7
Redundancy 2.3 4.3
Rsym (I),* % 5.2 (32.0) 11.1 (33.8)
R/RFree, % 21.7/26.4 25.4/31.4
rmsd bonds, Å 0.0067 0.0089
rmsd angles, ° 1.337 1.708
Residues in model
    γ 2–34; 49–340; 348–415; GDP-Mg2+ 2–415; GDP, Pi
    β 2–19 3–22; 28–139; Zn
    α3 176–265 174–266
Mean B values
    γ 47 57
    β 62 64
    α3 38 113
    GDP 59 67
    Pi 72
    Mg2+ 51
    Zn (β subunit) 58
    Water 48 29§

Ramachandran plots are shown in SI Fig. 10.

*Values in parentheses are Rsym (I) in the highest shell of resolution.

Rfree was calculated with 6% of the reflections.

Included in the model were 253 water molecules.

§This value corresponds to the B value of the Pi bound water molecule.