Data quality metrics extracted from 5uqx.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": "ed0caa7a7a2ebe67aa3cd66f20fa9cbc",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 76.355,
    "b": 67.533,
    "c": 76.861,
    "alpha": 90.00,
    "beta": 96.99,
    "gamma": 90.00
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [38.145,2.23],
    "number_observations_unique": 37714,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.211
      },
      {
        "type": "R(pim)",
        "value": 0.113
      },
      {
        "type": "I/SigI",
        "value": 9.100
      },
      {
        "type": "Completeness",
        "value": 96.800
      },
      {
        "type": "Redundancy",
        "value": 3.800
      },
      {
        "type": "CC(1/2)",
        "value": 0.595
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.242,2.234],
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.111
        },
        {
          "type": "R(pim)",
          "value": 0.581
        },
        {
          "type": "Completeness",
          "value": 96.000
        },
        {
          "type": "Redundancy",
          "value": 4.000
        },
        {
          "type": "CC(1/2)",
          "value": 0.016
        }
      ]
    },
    {
      "resolution_limits": [76.305,10.362],
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.072
        },
        {
          "type": "R(pim)",
          "value": 0.039
        },
        {
          "type": "Completeness",
          "value": 94.100
        },
        {
          "type": "Redundancy",
          "value": 3.600
        },
        {
          "type": "CC(1/2)",
          "value": 0.985
        }
      ]
    }
  ]

}
  

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


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