Data quality metrics extracted from 9hts.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": "953bd8b1e21563fbfcd8ae3582e4ca01",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 28.833,
    "b": 121.797,
    "c": 44.547,
    "alpha": 90.000,
    "beta": 108.545,
    "gamma": 90.000
  },
  "wavelengths": [0.97950],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [60.899,2.198],
    "number_observations_unique": 10852,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 7.5
      },
      {
        "type": "Completeness",
        "value": 73.3
      },
      {
        "type": "Redundancy",
        "value": 5.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.995
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.26,2.2],
      "number_observations_unique": 183,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.577
        }
      ]
    }
  ]

}
  

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


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