Data quality metrics extracted from 5m29.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": "e0b0281242f3eaac043689642dfa3951",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 138.15,
    "b": 90.56,
    "c": 50.84,
    "alpha": 90.0,
    "beta": 110.9,
    "gamma": 90.0
  },
  "wavelengths": [1.00001],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [29.39,1.5],
    "number_observations_unique": 89615,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.059
      },
      {
        "type": "I/SigI",
        "value": 10.16
      },
      {
        "type": "Completeness",
        "value": 96.02
      },
      {
        "type": "Redundancy",
        "value": 3.5
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.69,1.50],
      "number_observations": 8600,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.849
        }
      ]
    }
  ]

}
  

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


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