Data quality metrics extracted from 5mx2.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": "f0af776c52a19c37acd12cf96de4b731",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 116.326,
    "b": 219.617,
    "c": 304.043,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.91841],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.7,2.197],
    "number_observations_unique": 364603,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.25
      },
      {
        "type": "I/SigI",
        "value": 9.34
      },
      {
        "type": "Completeness",
        "value": 93
      },
      {
        "type": "Redundancy",
        "value": 11.2
      },
      {
        "type": "CC(1/2)",
        "value": 0.993
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.276,2.197],
      "number_observations_unique": 25404,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.27
        },
        {
          "type": "I/SigI",
          "value": 0.44
        },
        {
          "type": "Completeness",
          "value": 65
        },
        {
          "type": "Redundancy",
          "value": 5.2
        },
        {
          "type": "CC(1/2)",
          "value": 0.132
        }
      ]
    }
  ]

}
  

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


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