Data quality metrics extracted from 6v80.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": "4f0b090db29f00edc1cd06632e8ae16a",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 210.667,
    "b": 165.250,
    "c": 84.497,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.95365],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [82.820,3.530],
    "number_observations_unique": 35574,
    "quality_factors": [
      {
        "type": "R(pim)",
        "value": 0.117
      },
      {
        "type": "I/SigI",
        "value": 6.000
      },
      {
        "type": "Completeness",
        "value": 100.000
      },
      {
        "type": "Redundancy",
        "value": 15.200
      },
      {
        "type": "CC(1/2)",
        "value": 0.988
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.700,3.530],
      "number_observations_unique": 4684,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.729
        },
        {
          "type": "I/SigI",
          "value": 2.000
        },
        {
          "type": "Completeness",
          "value": 99.700
        },
        {
          "type": "Redundancy",
          "value": 15.700
        },
        {
          "type": "CC(1/2)",
          "value": 0.462
        }
      ]
    }
  ]

}
  

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


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