Data quality metrics extracted from 7u5x.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": "e2c87dfe7f156eb7eb2cb64813ac4b43",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 42.23,
    "b": 41.26,
    "c": 72.07,
    "alpha": 90.00,
    "beta": 104.17,
    "gamma": 90.00
  },
  "wavelengths": [0.97920],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [69.880,1.040],
    "number_observations": 564544,
    "number_observations_unique": 90335,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.067
      },
      {
        "type": "R(pim)",
        "value": 0.026
      },
      {
        "type": "I/SigI",
        "value": 13.700
      },
      {
        "type": "Completeness",
        "value": 78.200
      },
      {
        "type": "Redundancy",
        "value": 6.200
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.060,1.040],
      "number_observations": 1265,
      "number_observations_unique": 442,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.494
        },
        {
          "type": "R(pim)",
          "value": 0.836
        },
        {
          "type": "I/SigI",
          "value": 0.700
        },
        {
          "type": "Completeness",
          "value": 7.600
        },
        {
          "type": "Redundancy",
          "value": 2.900
        }
      ]
    },
    {
      "resolution_limits": [70.040,2.820],
      "number_observations": 37627,
      "number_observations_unique": 5912,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.053
        },
        {
          "type": "R(pim)",
          "value": 0.020
        },
        {
          "type": "I/SigI",
          "value": 29.400
        },
        {
          "type": "Completeness",
          "value": 99.400
        },
        {
          "type": "Redundancy",
          "value": 6.400
        }
      ]
    }
  ]

}
  

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


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