Data quality metrics extracted from 6hlf.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": "f9c0a18d2018be3369a593c44b7647da",
  "space_group_name": "I 2 2 2",
  "unit_cell": {
    "a": 55.58,
    "b": 81.78,
    "c": 114.89,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.96800],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [45.97,1.55],
    "number_observations_unique": 38205,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.08059
      },
      {
        "type": "R(meas)",
        "value": 0.08545
      },
      {
        "type": "R(pim)",
        "value": 0.02802
      },
      {
        "type": "I/SigI",
        "value": 17.07
      },
      {
        "type": "Completeness",
        "value": 99.60
      },
      {
        "type": "Redundancy",
        "value": 9.1
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.608,1.552],
      "number_observations_unique": 3772,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.356
        },
        {
          "type": "R(meas)",
          "value": 2.494
        },
        {
          "type": "R(pim)",
          "value": 0.8105
        },
        {
          "type": "I/SigI",
          "value": 0.74
        },
        {
          "type": "Completeness",
          "value": 97.39
        },
        {
          "type": "Redundancy",
          "value": 9.2
        },
        {
          "type": "CC(1/2)",
          "value": 0.405
        }
      ]
    }
  ]

}
  

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


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