Data quality metrics extracted from 8vqk.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": "9b84d9fb2df99fdba2b35d3623154a7c",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 63.216,
    "b": 63.290,
    "c": 74.314,
    "alpha": 110.01,
    "beta": 91.09,
    "gamma": 118.66
  },
  "wavelengths": [0.97946],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [38.40,1.95],
    "number_observations_unique": 61761,
    "quality_factors": [
      {
        "type": "R(pim)",
        "value": 0.088
      },
      {
        "type": "I/SigI",
        "value": 3.9
      },
      {
        "type": "Completeness",
        "value": 91.4
      },
      {
        "type": "Redundancy",
        "value": 3.9
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.06,1.95],
      "number_observations_unique": 6203,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.293
        }
      ]
    }
  ]

}
  

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


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