Data quality metrics extracted from 6c0k.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": "69fc276eebc00eb5689725fe8a2c80f5",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 162.612,
    "b": 73.046,
    "c": 109.438,
    "alpha": 90.00,
    "beta": 100.47,
    "gamma": 90.00
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,1.958],
    "number_observations_unique": 88875,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.06189
      },
      {
        "type": "R(meas)",
        "value": 0.07338
      },
      {
        "type": "I/SigI",
        "value": 12.26
      },
      {
        "type": "Completeness",
        "value": 97.7
      },
      {
        "type": "Redundancy",
        "value": 3.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.08,1.96],
      "number_observations_unique": 13984,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.235
        },
        {
          "type": "R(meas)",
          "value": 1.466
        },
        {
          "type": "I/SigI",
          "value": 1.02
        },
        {
          "type": "Completeness",
          "value": 95.3
        },
        {
          "type": "Redundancy",
          "value": 3.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.403
        }
      ]
    }
  ]

}
  

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


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