Data quality metrics extracted from 9yjr.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "c76005d66e2f985acdd3cb30800274f3",
  "space_group_name": "P 43 21 2",
  "unit_cell": {
    "a": 60.100,
    "b": 60.100,
    "c": 307.177,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97720],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [47.33,2.8],
    "number_observations_unique": 16747,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.2915
      },
      {
        "type": "R(meas)",
        "value": 0.3041
      },
      {
        "type": "R(pim)",
        "value": 0.08589
      },
      {
        "type": "I/SigI",
        "value": 5.99
      },
      {
        "type": "Completeness",
        "value": 96.87
      },
      {
        "type": "Redundancy",
        "value": 12.2
      },
      {
        "type": "CC(1/2)",
        "value": 0.996
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.02,2.8],
      "number_observations_unique": 3243,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.998
        },
        {
          "type": "R(meas)",
          "value": 3.145
        },
        {
          "type": "R(pim)",
          "value": 0.9403
        },
        {
          "type": "I/SigI",
          "value": 0.85
        },
        {
          "type": "Completeness",
          "value": 84.44
        },
        {
          "type": "Redundancy",
          "value": 10.9
        },
        {
          "type": "CC(1/2)",
          "value": 0.398
        }
      ]
    }
  ]

}
  

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


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