Data quality metrics extracted from 7bo4.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": "969d0331e1f21d820e1c5212e95887bc",
  "space_group_name": "I 4 2 2",
  "unit_cell": {
    "a": 155.30,
    "b": 155.30,
    "c": 128.06,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97856],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.40,2.401],
    "number_observations_unique": 30671,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1548
      },
      {
        "type": "R(meas)",
        "value": 0.1578
      },
      {
        "type": "R(pim)",
        "value": 0.03031
      },
      {
        "type": "I/SigI",
        "value": 16.51
      },
      {
        "type": "Completeness",
        "value": 99.58
      },
      {
        "type": "Redundancy",
        "value": 26.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.487,2.401],
      "number_observations_unique": 2922,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.179
        },
        {
          "type": "R(meas)",
          "value": 2.222
        },
        {
          "type": "R(pim)",
          "value": 0.4271
        },
        {
          "type": "I/SigI",
          "value": 1.84
        },
        {
          "type": "CC(1/2)",
          "value": 0.637
        }
      ]
    }
  ]

}
  

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


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