Data quality metrics extracted from 1qrv.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": "9c67bf202cb96de66d8703e279e5d09f",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 43.740,
    "b": 53.797,
    "c": 86.843,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.90000,0.92110,0.92157,1.05000,1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20.,2.2],
    "number_observations_unique": 10672,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.0520000
      },
      {
        "type": "I/SigI",
        "value": 24.2
      },
      {
        "type": "Completeness",
        "value": 98.0
      },
      {
        "type": "Redundancy",
        "value": 8.8
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.28,2.2],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.1980000
        },
        {
          "type": "Completeness",
          "value": 97.9
        },
        {
          "type": "Redundancy",
          "value": 4.4
        }
      ]
    }
  ]

}
  

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


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