Data quality metrics extracted from 7ygq.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": "7ee454e9e264bd5f7f2eb0e48b39efde",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 55.056,
    "b": 60.592,
    "c": 68.303,
    "alpha": 91.201,
    "beta": 102.721,
    "gamma": 108.432
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [31.4,2.04],
    "number_observations_unique": 50175,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.028
      },
      {
        "type": "I/SigI",
        "value": 9.3
      },
      {
        "type": "Completeness",
        "value": 96.4
      },
      {
        "type": "Redundancy",
        "value": 3.5
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.15,2.04],
      "number_observations_unique": 7358,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.316
        }
      ]
    }
  ]

}
  

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


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