Data quality metrics extracted from 9uo7.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": "258a879d9563c6712bddc71b9c269eb3",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 33.381,
    "b": 68.525,
    "c": 46.449,
    "alpha": 90.00,
    "beta": 110.07,
    "gamma": 90.00
  },
  "wavelengths": [0.97850],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [36.80,1.3],
    "number_observations_unique": 48179,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.04
      },
      {
        "type": "I/SigI",
        "value": 46.34
      },
      {
        "type": "Completeness",
        "value": 99.8
      },
      {
        "type": "Redundancy",
        "value": 10
      },
      {
        "type": "CC(1/2)",
        "value": 0.759
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.346,1.3],
      "number_observations_unique": 4802,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.395
        },
        {
          "type": "CC(1/2)",
          "value": 0.656
        }
      ]
    }
  ]

}
  

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


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