Data quality metrics extracted from 5goi.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": "7915693a9ab0b8f481ad934b53536659",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 28.01,
    "b": 40.80,
    "c": 52.16,
    "alpha": 98.45,
    "beta": 100.90,
    "gamma": 105.94
  },
  "wavelengths": [0.97920],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [38.351,1.594],
    "number_observations_unique": 23441,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.089
      },
      {
        "type": "I/SigI",
        "value": 4.00
      },
      {
        "type": "Completeness",
        "value": 82
      },
      {
        "type": "Redundancy",
        "value": 1.69
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.64,1.59],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.086
        },
        {
          "type": "Redundancy",
          "value": 1.62
        }
      ]
    }
  ]

}
  

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


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