Data quality metrics extracted from 9hjo.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": "6a19bed943820736cfd5fa5999f785f4",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 61.008,
    "b": 69.975,
    "c": 86.760,
    "alpha": 91.629,
    "beta": 89.929,
    "gamma": 115.952
  },
  "wavelengths": [1.06000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [86.72,2.4],
    "number_observations_unique": 48487,
    "quality_factors": [
      {
        "type": "R(pim)",
        "value": 0.054
      },
      {
        "type": "I/SigI",
        "value": 17.0
      },
      {
        "type": "Completeness",
        "value": 96.2
      },
      {
        "type": "Redundancy",
        "value": 3.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.44,2.40],
      "number_observations_unique": 1780,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.928
        },
        {
          "type": "I/SigI",
          "value": 1.1
        },
        {
          "type": "Completeness",
          "value": 70.19
        },
        {
          "type": "CC(1/2)",
          "value": 0.344
        }
      ]
    }
  ]

}
  

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


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