Data quality metrics extracted from 2ban.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": "c2df14c8bb35914be5dc417ccb491185",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 226.24,
    "b": 69.43,
    "c": 104.45,
    "alpha": 90.00,
    "beta": 106.49,
    "gamma": 90.00
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.00,2.95],
    "number_observations_unique": 31625,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.063
      },
      {
        "type": "Completeness",
        "value": 95.500
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.06,2.95],
      "number_observations": 2544,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.404
        },
        {
          "type": "Completeness",
          "value": 77.4
        }
      ]
    }
  ]

}
  

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


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