Data quality metrics extracted from 6q7f.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": "88cee6aceca6562b44a5ff9aea5219d3",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 32.671,
    "b": 107.062,
    "c": 40.524,
    "alpha": 90.00,
    "beta": 108.83,
    "gamma": 90.00
  },
  "wavelengths": [0.97625],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [38.355,1.204],
    "number_observations_unique": 76625,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.158
      },
      {
        "type": "I/SigI",
        "value": 6.84
      },
      {
        "type": "Completeness",
        "value": 94.2
      },
      {
        "type": "Redundancy",
        "value": 6.98
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.28,1.204],
      "number_observations_unique": 11339,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.3
        },
        {
          "type": "Completeness",
          "value": 86.5
        },
        {
          "type": "Redundancy",
          "value": 6.74
        },
        {
          "type": "CC(1/2)",
          "value": 0.104
        }
      ]
    }
  ]

}
  

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


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