Data quality metrics extracted from 7lpw.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": "1a8ef41458b6da13de2c8113af7753e6",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 161.433,
    "b": 72.953,
    "c": 107.747,
    "alpha": 90.000,
    "beta": 99.874,
    "gamma": 90.000
  },
  "wavelengths": [0.96868],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [34.82,2.316],
    "number_observations_unique": 53283,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.071
      },
      {
        "type": "R(meas)",
        "value": 0.077
      },
      {
        "type": "R(pim)",
        "value": 0.03
      },
      {
        "type": "I/SigI",
        "value": 23.6
      },
      {
        "type": "Completeness",
        "value": 99.1
      },
      {
        "type": "Redundancy",
        "value": 5.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.996
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.35,2.316],
      "number_observations_unique": 2395,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.58
        },
        {
          "type": "R(meas)",
          "value": 0.67
        },
        {
          "type": "R(pim)",
          "value": 0.33
        },
        {
          "type": "I/SigI",
          "value": 2.0
        },
        {
          "type": "Completeness",
          "value": 90.3
        },
        {
          "type": "Redundancy",
          "value": 3.6
        },
        {
          "type": "CC(1/2)",
          "value": 0.49
        }
      ]
    }
  ]

}
  

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


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