Data quality metrics extracted from 6mcy.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": "d5711179da3e68e3aa86b1558e7bb6a2",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 36.951,
    "b": 59.261,
    "c": 79.207,
    "alpha": 93.14,
    "beta": 93.35,
    "gamma": 97.63
  },
  "wavelengths": [0.95370],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [36.54,1.748],
    "number_observations_unique": 65510,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1098
      },
      {
        "type": "R(pim)",
        "value": 0.06454
      },
      {
        "type": "I/SigI",
        "value": 9.08
      },
      {
        "type": "Completeness",
        "value": 97.55
      },
      {
        "type": "Redundancy",
        "value": 3.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.811,1.748],
      "number_observations_unique": 6395,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.72
        },
        {
          "type": "Completeness",
          "value": 95.24
        },
        {
          "type": "CC(1/2)",
          "value": 0.326
        }
      ]
    }
  ]

}
  

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


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