Data quality metrics extracted from 6t22.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": "8997ad4f7611dd7a126c769a74512198",
  "space_group_name": "P 61 2 2",
  "unit_cell": {
    "a": 113.417,
    "b": 113.417,
    "c": 156.367,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.91950],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [33.54,2.21],
    "number_observations_unique": 30298,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.084
      },
      {
        "type": "R(meas)",
        "value": 0.086
      },
      {
        "type": "I/SigI",
        "value": 38.15
      },
      {
        "type": "Completeness",
        "value": 99.2
      },
      {
        "type": "Redundancy",
        "value": 35.8
      },
      {
        "type": "CC(1/2)",
        "value": 1.000
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.34,2.21],
      "number_observations_unique": 4597,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.761
        },
        {
          "type": "R(meas)",
          "value": 1.802
        },
        {
          "type": "I/SigI",
          "value": 1.91
        },
        {
          "type": "Completeness",
          "value": 95.4
        },
        {
          "type": "Redundancy",
          "value": 20.8
        },
        {
          "type": "CC(1/2)",
          "value": 0.734
        }
      ]
    }
  ]

}
  

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


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