Data quality metrics extracted from 9tov.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": "3acce3dac16f5c05998943ec88ccb7f4",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 119.070,
    "b": 77.836,
    "c": 99.306,
    "alpha": 90.000,
    "beta": 116.453,
    "gamma": 90.000
  },
  "wavelengths": [1.30420],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [59.18,3.5],
    "number_observations_unique": 10398,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 3.818
      },
      {
        "type": "Completeness",
        "value": 99.97
      },
      {
        "type": "Redundancy",
        "value": 37.97
      },
      {
        "type": "CC(1/2)",
        "value": 0.683
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.5604,3.5],
      "number_observations_unique": 516,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 2.917
        },
        {
          "type": "Completeness",
          "value": 100.0
        },
        {
          "type": "Redundancy",
          "value": 16.64
        },
        {
          "type": "CC(1/2)",
          "value": 0.132
        }
      ]
    }
  ]

}
  

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


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