Data quality metrics extracted from 6cmc.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": "801bc460b4471c272ffb46f72b564c28",
  "space_group_name": "H 3",
  "unit_cell": {
    "a": 133.938,
    "b": 133.938,
    "c": 122.671,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.93725],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [42.14,3.67],
    "number_observations_unique": 8949,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 6.78
      },
      {
        "type": "Completeness",
        "value": 99.61
      },
      {
        "type": "Redundancy",
        "value": 8.12
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.80,3.67],
      "quality_factors": [

      ]
    }
  ]

}
  

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


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