Data quality metrics extracted from 6w0q.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": "7d1505abf8d37ade207c88eff0186b07",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 44.435,
    "b": 60.496,
    "c": 72.982,
    "alpha": 83.512,
    "beta": 79.622,
    "gamma": 88.615
  },
  "wavelengths": [1.54000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [24.81,1.89],
    "number_observations_unique": 111259,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.087
      },
      {
        "type": "I/SigI",
        "value": 18
      },
      {
        "type": "Completeness",
        "value": 99.8
      },
      {
        "type": "Redundancy",
        "value": 4.1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.93,1.90],
      "number_observations_unique": 5232,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.545
        },
        {
          "type": "I/SigI",
          "value": 2.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.773
        }
      ]
    }
  ]

}
  

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


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