Data quality metrics extracted from 7lip.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": "b2d06022d435b39c170d222965c365f5",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 84.766,
    "b": 43.450,
    "c": 51.026,
    "alpha": 90.000,
    "beta": 123.217,
    "gamma": 90.000
  },
  "wavelengths": [0.97940],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [21.32,1.48],
    "number_observations_unique": 25043,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.085
      },
      {
        "type": "R(meas)",
        "value": 0.091
      },
      {
        "type": "R(pim)",
        "value": 0.032
      },
      {
        "type": "I/SigI",
        "value": 20.56
      },
      {
        "type": "Completeness",
        "value": 95.90
      },
      {
        "type": "Redundancy",
        "value": 8.1
      },
      {
        "type": "CC(1/2)",
        "value": 1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.53,1.48],
      "number_observations_unique": 2391,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.66
        },
        {
          "type": "R(meas)",
          "value": 0.72
        },
        {
          "type": "R(pim)",
          "value": 0.26
        },
        {
          "type": "I/SigI",
          "value": 3.24
        },
        {
          "type": "CC(1/2)",
          "value": 0.87
        }
      ]
    }
  ]

}
  

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


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