Data quality metrics extracted from 1uwc.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": "21e4d21a1f0437662bbdc0d920b5df82",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 38.759,
    "b": 40.182,
    "c": 77.953,
    "alpha": 74.96,
    "beta": 78.63,
    "gamma": 71.10
  },
  "wavelengths": [0.87000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [25.000,1.080],
    "number_observations_unique": 170583,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.05800
      },
      {
        "type": "I/SigI",
        "value": 15.8000
      },
      {
        "type": "Completeness",
        "value": 93.5
      },
      {
        "type": "Redundancy",
        "value": 2.900
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.12,1.08],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.26000
        },
        {
          "type": "I/SigI",
          "value": 2.500
        },
        {
          "type": "Completeness",
          "value": 82.0
        },
        {
          "type": "Redundancy",
          "value": 1.80
        }
      ]
    }
  ]

}
  

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


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