Data quality metrics extracted from 7ntw.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": "8429fbd7aa84c033862623f67ac28713",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 113.31,
    "b": 53.68,
    "c": 44.72,
    "alpha": 90.00,
    "beta": 101.67,
    "gamma": 90.00
  },
  "wavelengths": [0.97856],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.37,1.815],
    "number_observations_unique": 23721,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 12.8
      },
      {
        "type": "Completeness",
        "value": 99.0
      },
      {
        "type": "Redundancy",
        "value": 6.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.85,1.815],
      "number_observations_unique": 1352,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 94.2
        },
        {
          "type": "CC(1/2)",
          "value": 0.423
        }
      ]
    }
  ]

}
  

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


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