Data quality metrics extracted from 2hox.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": "f0962fa28e354cfa2f7ee6489aa6932f",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 67.665,
    "b": 126.892,
    "c": 102.664,
    "alpha": 90.0,
    "beta": 97.3,
    "gamma": 90.0
  },
  "wavelengths": [0.93330,0.93300],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.100,1.390],
    "number_observations_unique": 327315,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.049
      },
      {
        "type": "I/SigI",
        "value": 40.4000
      },
      {
        "type": "Completeness",
        "value": 95.7
      },
      {
        "type": "Redundancy",
        "value": 3.080
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.41,1.39],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.598
        },
        {
          "type": "I/SigI",
          "value": 2.100
        },
        {
          "type": "Completeness",
          "value": 78.1
        },
        {
          "type": "Redundancy",
          "value": 2.20
        }
      ]
    }
  ]

}
  

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


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