Data quality metrics extracted from 8hfk.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": "1208e735f73e2eaae8b4dd9e8bac795e",
  "space_group_name": "P 41 21 2",
  "unit_cell": {
    "a": 124.867,
    "b": 124.867,
    "c": 133.195,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.54200],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [24.25,2.875],
    "number_observations_unique": 23926,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 8.3
      },
      {
        "type": "Completeness",
        "value": 99.6
      },
      {
        "type": "Redundancy",
        "value": 9.8
      },
      {
        "type": "CC(1/2)",
        "value": 0.987
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.978,2.875],
      "number_observations_unique": 45957,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.303
        }
      ]
    },
    {
      "resolution_limits": [3.097,2.978],
      "number_observations_unique": 41801,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.290
        }
      ]
    },
    {
      "resolution_limits": [3.237,3.097],
      "number_observations_unique": 37156,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.271
        }
      ]
    },
    {
      "resolution_limits": [3.407,3.237],
      "number_observations_unique": 32567,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.251
        }
      ]
    },
    {
      "resolution_limits": [3.620,3.407],
      "number_observations_unique": 27926,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.229
        }
      ]
    },
    {
      "resolution_limits": [3.899,3.620],
      "number_observations_unique": 23308,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.209
        }
      ]
    }
  ]

}
  

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


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