Data quality metrics extracted from 5lpu.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": "298a4a44e40c9dba26fdf148da2606f1",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 71.74,
    "b": 61.24,
    "c": 148.16,
    "alpha": 90.00,
    "beta": 88.69,
    "gamma": 90.00
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.374,2.1],
    "number_observations_unique": 75455,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.067
      },
      {
        "type": "I/SigI",
        "value": 23.1
      },
      {
        "type": "Completeness",
        "value": 99.98
      },
      {
        "type": "Redundancy",
        "value": 13.6
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.17,2.1],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 2.42
        },
        {
          "type": "Completeness",
          "value": 99.87
        }
      ]
    }
  ]

}
  

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


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