Data quality metrics extracted from 3cxi.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": "c8de90c338ad574d43640e9e8b60eef6",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 38.37,
    "b": 70.13,
    "c": 43.83,
    "alpha": 90.00,
    "beta": 102.23,
    "gamma": 90.00
  },
  "wavelengths": [1.42100],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.0,1.83],
    "number_observations_unique": 19343,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 96.3
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.90,1.83],
      "quality_factors": [

      ]
    }
  ]

}
  

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


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