Data quality metrics extracted from 1ofq.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": "34cb8ad9a2e8090de0eef98e0c8c5b2d",
  "space_group_name": "P 31 2 1",
  "unit_cell": {
    "a": 105.731,
    "b": 105.731,
    "c": 268.782,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.80000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [19.800,2.400],
    "number_observations_unique": 68895,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.04600
      },
      {
        "type": "I/SigI",
        "value": 26.5000
      },
      {
        "type": "Completeness",
        "value": 99.5
      },
      {
        "type": "Redundancy",
        "value": 8.800
      }
    ]
  }
}
  

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


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