Data quality metrics extracted from 6gw2.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": "cf89befd1215d05215221cfbf7ede34c",
  "space_group_name": "P 21 2 21",
  "unit_cell": {
    "a": 79.83,
    "b": 87.91,
    "c": 108.34,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97372],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.12,2.05],
    "number_observations_unique": 48586,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.09804
      },
      {
        "type": "R(meas)",
        "value": 0.107
      },
      {
        "type": "R(pim)",
        "value": 0.04248
      },
      {
        "type": "I/SigI",
        "value": 11.02
      },
      {
        "type": "Completeness",
        "value": 99.65
      },
      {
        "type": "Redundancy",
        "value": 6.3
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.12,2.05],
      "number_observations_unique": 4669,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.6477
        },
        {
          "type": "R(meas)",
          "value": 0.7062
        },
        {
          "type": "R(pim)",
          "value": 0.2783
        },
        {
          "type": "I/SigI",
          "value": 2.26
        },
        {
          "type": "Completeness",
          "value": 97.33
        },
        {
          "type": "Redundancy",
          "value": 6.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.793
        }
      ]
    }
  ]

}
  

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


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