Data quality metrics extracted from 4xgz.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": "468b8104dc9f1875dd3d3d35ea59ea93",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 108.189,
    "b": 111.004,
    "c": 143.865,
    "alpha": 94.65,
    "beta": 95.28,
    "gamma": 114.53
  },
  "wavelengths": [0.97920],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [142,2.50],
    "number_observations_unique": 207767,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.09100
      },
      {
        "type": "I/SigI",
        "value": 7.4000
      },
      {
        "type": "Completeness",
        "value": 94.3
      },
      {
        "type": "Redundancy",
        "value": 2.300
      }
    ]
  }
}
  

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


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