Data quality metrics extracted from 5o5x.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": "47c912c8a77e4de743b4135ba03853a3",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 95.19,
    "b": 99.27,
    "c": 113.45,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97857],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.73,2.148],
    "number_observations_unique": 58644,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.0531
      },
      {
        "type": "R(meas)",
        "value": 0.06014
      },
      {
        "type": "R(pim)",
        "value": 0.0275
      },
      {
        "type": "I/SigI",
        "value": 14.24
      },
      {
        "type": "Completeness",
        "value": 98.88
      },
      {
        "type": "Redundancy",
        "value": 4.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.225,2.148],
      "number_observations_unique": 5574,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.9124
        },
        {
          "type": "R(pim)",
          "value": 0.4792
        },
        {
          "type": "Completeness",
          "value": 95.59
        },
        {
          "type": "Redundancy",
          "value": 4.4
        },
        {
          "type": "CC(1/2)",
          "value": 0.677
        }
      ]
    }
  ]

}
  

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


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