Data quality metrics extracted from 6hd0.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": "781142c2e531a149a1f2916aa8dc4736",
  "space_group_name": "P 31",
  "unit_cell": {
    "a": 185.120,
    "b": 185.120,
    "c": 122.426,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.91841],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.980,3.728],
    "number_observations_unique": 28980,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.306
      },
      {
        "type": "R(meas)",
        "value": 0.34
      },
      {
        "type": "R(pim)",
        "value": 0.148
      },
      {
        "type": "I/SigI",
        "value": 6.2
      },
      {
        "type": "Completeness",
        "value": 90.7
      },
      {
        "type": "Redundancy",
        "value": 5.3
      },
      {
        "type": "CC(1/2)",
        "value": 0.983
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [4.03,3.88],
      "number_observations_unique": 668,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.2686
        },
        {
          "type": "I/SigI",
          "value": 0.75
        },
        {
          "type": "Completeness",
          "value": 98.1
        },
        {
          "type": "CC(1/2)",
          "value": 0.324
        }
      ]
    }
  ]

}
  

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


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