Data quality metrics extracted from 4o02.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": "287d7d01a9ca3326403d364e141c2bbe",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 110.464,
    "b": 266.988,
    "c": 102.163,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97857],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.000,3.600],
    "number_observations_unique": 31351,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.13100
      },
      {
        "type": "I/SigI",
        "value": 8.3000
      },
      {
        "type": "Completeness",
        "value": 87.9
      },
      {
        "type": "Redundancy",
        "value": 3.800
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.73,3.60],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.86600
        },
        {
          "type": "I/SigI",
          "value": 1.000
        },
        {
          "type": "Completeness",
          "value": 55.2
        },
        {
          "type": "Redundancy",
          "value": 2.80
        }
      ]
    }
  ]

}
  

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


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