Data quality metrics extracted from 6zg3.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": "0c820d0905975e61356d2c44c68c19c7",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 97.29,
    "b": 110.47,
    "c": 110.50,
    "alpha": 88.997,
    "beta": 102.271,
    "gamma": 102.244
  },
  "wavelengths": [0.91587],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.83,2.8],
    "number_observations_unique": 104704,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 4.7
      },
      {
        "type": "Completeness",
        "value": 96.7
      },
      {
        "type": "Redundancy",
        "value": 1.72
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.87,2.80],
      "number_observations_unique": 7625,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 95
        },
        {
          "type": "CC(1/2)",
          "value": 0.195
        }
      ]
    }
  ]

}
  

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


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