Data quality metrics extracted from 7t8s.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": "cbf40ea88d87ab810c06660d979f9778",
  "space_group_name": "P 41 21 2",
  "unit_cell": {
    "a": 178.359,
    "b": 178.359,
    "c": 173.546,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.26320],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [26.77,2.00],
    "number_observations_unique": 187274,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.05641
      },
      {
        "type": "R(meas)",
        "value": 0.07977
      },
      {
        "type": "R(pim)",
        "value": 0.05641
      },
      {
        "type": "I/SigI",
        "value": 6.18
      },
      {
        "type": "Completeness",
        "value": 99.78
      },
      {
        "type": "Redundancy",
        "value": 2.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.995
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.03,2.00],
      "number_observations_unique": 9197,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.529
        },
        {
          "type": "R(pim)",
          "value": 0.930
        },
        {
          "type": "I/SigI",
          "value": 0.9
        },
        {
          "type": "Completeness",
          "value": 100.0
        },
        {
          "type": "Redundancy",
          "value": 7.2
        },
        {
          "type": "CC(1/2)",
          "value": 0.572
        }
      ]
    }
  ]

}
  

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


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