Data quality metrics extracted from 5mph.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": "1dd315f7e64fddd62e556a55f5a5ca99",
  "space_group_name": "P 61 2 2",
  "unit_cell": {
    "a": 106.752,
    "b": 106.752,
    "c": 115.634,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.50000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.02,2.337],
    "number_observations_unique": 17043,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.06034
      },
      {
        "type": "I/SigI",
        "value": 35.62
      },
      {
        "type": "Completeness",
        "value": 99.98
      },
      {
        "type": "Redundancy",
        "value": 24.9
      },
      {
        "type": "CC(1/2)",
        "value": 1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.421,2.337],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.918
        },
        {
          "type": "I/SigI",
          "value": 1.88
        },
        {
          "type": "Completeness",
          "value": 99.88
        },
        {
          "type": "Redundancy",
          "value": 24.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.863
        }
      ]
    }
  ]

}
  

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


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