Data quality metrics extracted from 5yuq.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": "4c8e42c46ff274e9ac39f71740a0652d",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 54.194,
    "b": 68.678,
    "c": 77.347,
    "alpha": 116.30,
    "beta": 103.45,
    "gamma": 90.12
  },
  "wavelengths": [0.97930],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [30.56,1.56],
    "number_observations_unique": 131773,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 13.74
      },
      {
        "type": "Completeness",
        "value": 95.86
      },
      {
        "type": "Redundancy",
        "value": 15
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.616,1.56],
      "number_observations_unique": 12911,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 2.9
        },
        {
          "type": "Completeness",
          "value": 94.12
        }
      ]
    }
  ]

}
  

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


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