Data quality metrics extracted from 8b93.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": "7340792d4ed7d0108bef01567181e7a4",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 59.979,
    "b": 85.479,
    "c": 121.588,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.03320],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [45.53,2.21],
    "number_observations_unique": 29412,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.334
      },
      {
        "type": "I/SigI",
        "value": 3.79
      },
      {
        "type": "Completeness",
        "value": 91.8
      },
      {
        "type": "Redundancy",
        "value": 5.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.971
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.34,2.21],
      "number_observations_unique": 4613,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.374
        },
        {
          "type": "I/SigI",
          "value": 1.60
        },
        {
          "type": "Completeness",
          "value": 90.8
        },
        {
          "type": "Redundancy",
          "value": 5.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.625
        }
      ]
    }
  ]

}
  

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


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