Data quality metrics extracted from 6r2m.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": "d533bf5f28013778085d68d09e83b7c3",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 40.08,
    "b": 71.56,
    "c": 131.30,
    "alpha": 90.0,
    "beta": 95.8,
    "gamma": 90.0
  },
  "wavelengths": [0.97853],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [43.54,1.617],
    "number_observations_unique": 91306,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 59.37
      },
      {
        "type": "Completeness",
        "value": 94.57
      },
      {
        "type": "Redundancy",
        "value": 10.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.806
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.675,1.617],
      "number_observations_unique": 8707,
      "quality_factors": [

      ]
    }
  ]

}
  

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


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