Data quality metrics extracted from 6vvq.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": "d286bb49f3f556f67a5149b06d8c3a19",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 65.082,
    "b": 70.984,
    "c": 127.224,
    "alpha": 90.000,
    "beta": 96.133,
    "gamma": 90.000
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,3.1],
    "number_observations_unique": 21217,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.304
      },
      {
        "type": "R(pim)",
        "value": 0.121
      },
      {
        "type": "I/SigI",
        "value": 11.3
      },
      {
        "type": "Completeness",
        "value": 99.3
      },
      {
        "type": "Redundancy",
        "value": 5.8
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.21,3.1],
      "number_observations_unique": 2083,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.710
        },
        {
          "type": "Completeness",
          "value": 99.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.647
        }
      ]
    }
  ]

}
  

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


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