Data quality metrics extracted from 34lt.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": "40343bab08b50907bcbb9e780fb35497",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 57.103,
    "b": 106.497,
    "c": 110.639,
    "alpha": 102.274,
    "beta": 90.821,
    "gamma": 101.352
  },
  "wavelengths": [0.95370],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [54.020,2.50],
    "number_observations_unique": 85116,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.136
      },
      {
        "type": "R(meas)",
        "value": 0.160
      },
      {
        "type": "R(pim)",
        "value": 0.084
      },
      {
        "type": "I/SigI",
        "value": 6.6
      },
      {
        "type": "Completeness",
        "value": 98.7
      },
      {
        "type": "Redundancy",
        "value": 3.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.990
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.55,2.50],
      "number_observations": 16437,
      "number_observations_unique": 4456,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.878
        },
        {
          "type": "R(meas)",
          "value": 1.028
        },
        {
          "type": "R(pim)",
          "value": 0.532
        },
        {
          "type": "I/SigI",
          "value": 2.0
        },
        {
          "type": "Redundancy",
          "value": 3.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.697
        }
      ]
    }
  ]

}
  

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


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