Data quality metrics extracted from 8a0m.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": "ab1a4cc1c033f58d4856e4e483e663cc",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 127.911,
    "b": 232.806,
    "c": 129.177,
    "alpha": 90.00,
    "beta": 118.39,
    "gamma": 90.00
  },
  "wavelengths": [0.97950],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [63.94,3.6],
    "number_observations_unique": 76828,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.1831
      },
      {
        "type": "I/SigI",
        "value": 8.79
      },
      {
        "type": "Completeness",
        "value": 99.71
      },
      {
        "type": "Redundancy",
        "value": 7.1
      },
      {
        "type": "CC(1/2)",
        "value": 0.988
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.729,3.6],
      "number_observations_unique": 7658,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.8839
        },
        {
          "type": "I/SigI",
          "value": 1.38
        },
        {
          "type": "Completeness",
          "value": 99.75
        },
        {
          "type": "Redundancy",
          "value": 6.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.796
        }
      ]
    }
  ]

}
  

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


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