Data quality metrics extracted from 5kfv.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": "94ee7f592349b005a96dcca0e544dd9d",
  "space_group_name": "P 61",
  "unit_cell": {
    "a": 98.28,
    "b": 98.28,
    "c": 81.93,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20.000,1.600],
    "number_observations_unique": 58772,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.05900
      },
      {
        "type": "I/SigI",
        "value": 22.3100
      },
      {
        "type": "Completeness",
        "value": 99.2
      },
      {
        "type": "Redundancy",
        "value": 7.400
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.64,1.60],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.84100
        },
        {
          "type": "I/SigI",
          "value": 2.230
        },
        {
          "type": "Completeness",
          "value": 100.0
        }
      ]
    }
  ]

}
  

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


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