TABLE 2

Crystallographic statistics

Data CollectionD188Y-apoD188Y + ZoledronateYeast + Zoledronate (2E91 Re-refinement)
Space groupP43212P21
Cell dimensions
 a,b,c (Å)148.54, 148.54, 268.23116.80, 134.24, 134.46
 α,β,γ (°)90, 90, 9090, 102.68, 90
 BeamlineESRF ID30A-3ESRF ID30B
 Wavelength (Å)0.9680.976
 Resolution (Å)3.22.8
 Multiplicity4.543.27
 Completeness (%)98.497.1
 Mean I/σ(Ι)7.764.57
 Rmerge (%)20.522.2
Refinement statistics
 Number of reflections (work/free)a37,382/197875,669/404235,010/1847
 Resolution rangea48.7–3.2848.6–3.023.96–2.14
Rwork/Rfree0.209/0.2560.257/0.3040.2198/0.1758
Number of atoms
 Macromolecules12,96223,3694588
 Ligands3622838
 Solvent10354
Average B-factor
 Macromolecules76.492.5741.42
 Ligands76.882.3340.27
 Solvent46.5N/A49.23
 RMSD (bond lengths)0.0070.0090.01
 RMSD (bond angles)0.921.110.90
 Ramachandran outliers (%)00.060
  • ESRF, European Synchrotron Radiation Facility; RMSD, root-mean-square deviation.

  • a After anisotropic scaling.