Data quality metrics extracted from 3u75.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.2",
  "uuid": "2c1a34fefa2726c0fbbddaa755bbabe0",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 65.207,
    "b": 92.663,
    "c": 117.753,
    "alpha": 89.91,
    "beta": 82.96,
    "gamma": 85.82
  },
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [116.86,2.68],
    "number_observations_unique": 74146,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.22
      },
      {
        "type": "Completeness",
        "value": 96.4
      }
    ]
  }
}
  

Table 1 generated from MXLIMS-JSON (via JavaScript):


Binned data generated from MXLIMS-JSON (via JavaScript):