Data quality metrics extracted from 2bay.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": "514f51ae2c32e45a13b2c0c471d3e0e7",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 49.421,
    "b": 57.105,
    "c": 122.587,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.38100,0.97965,0.97934,0.92526],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [22.94,1.5],
    "number_observations_unique": 52748,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 93.3
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.57,1.50],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 86.8
        }
      ]
    }
  ]

}
  

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


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