Data quality metrics extracted from 7t8j.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": "874072f49cd513fc21f83eb94d0cb391",
  "space_group_name": "P 65",
  "unit_cell": {
    "a": 68.651,
    "b": 68.651,
    "c": 56.735,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.97950],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [34.33,1.89],
    "number_observations_unique": 12236,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.06456
      },
      {
        "type": "R(meas)",
        "value": 0.06703
      },
      {
        "type": "R(pim)",
        "value": 0.0179
      },
      {
        "type": "I/SigI",
        "value": 20.93
      },
      {
        "type": "Completeness",
        "value": 99.92
      },
      {
        "type": "Redundancy",
        "value": 14
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.959,1.89],
      "number_observations_unique": 1208,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.631
        },
        {
          "type": "R(meas)",
          "value": 0.99
        },
        {
          "type": "R(pim)",
          "value": 0.4415
        },
        {
          "type": "I/SigI",
          "value": 2.59
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 14.6
        },
        {
          "type": "CC(1/2)",
          "value": 0.903
        }
      ]
    }
  ]

}
  

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


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