Data quality metrics extracted from 8p4y.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": "57d57db5b81152ceeadc3fff8ff18422",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 33.84,
    "b": 36.98,
    "c": 44.67,
    "alpha": 97.25,
    "beta": 105.76,
    "gamma": 95.45
  },
  "wavelengths": [0.97857],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [36.35,2.05],
    "number_observations_unique": 12496,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.039
      },
      {
        "type": "I/SigI",
        "value": 15.08
      },
      {
        "type": "Completeness",
        "value": 97.5
      },
      {
        "type": "Redundancy",
        "value": 3.62
      },
      {
        "type": "CC(1/2)",
        "value": 0.99
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.126,2.052],
      "number_observations_unique": 1233,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.93
        },
        {
          "type": "I/SigI",
          "value": 1.32
        },
        {
          "type": "Completeness",
          "value": 96.18
        },
        {
          "type": "Redundancy",
          "value": 3.75
        },
        {
          "type": "CC(1/2)",
          "value": 0.69
        }
      ]
    }
  ]

}
  

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


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