Data quality metrics extracted from 9w0h.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "702950a1febfdf9eaaca3a82abae80de",
  "space_group_name": "C 2 2 21",
  "unit_cell": {
    "a": 71.911,
    "b": 301.701,
    "c": 70.055,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [38.5,3.0],
    "number_observations_unique": 18928,
    "quality_factors": [
      {
        "type": "R(pim)",
        "value": 0.104
      },
      {
        "type": "I/SigI",
        "value": 8.0
      },
      {
        "type": "Completeness",
        "value": 99.74
      },
      {
        "type": "Redundancy",
        "value": 7.9
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.1,3.0],
      "number_observations_unique": 15726,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.104
        }
      ]
    }
  ]

}
  

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


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