Data quality metrics extracted from 4gv8.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": "133c4a27bd35a25fbcb34f52a5957cac",
  "space_group_name": "P 43 2 2",
  "unit_cell": {
    "a": 109.66,
    "b": 109.66,
    "c": 169.27,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [47.104,2.10],
    "number_observations_unique": 60917,
    "quality_factors": [

    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.15,2.10],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.978
        },
        {
          "type": "I/SigI",
          "value": 3.07
        },
        {
          "type": "Redundancy",
          "value": 12.8
        }
      ]
    },
    {
      "resolution_limits": [47.10,2.15],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.058
        },
        {
          "type": "I/SigI",
          "value": 34.37
        },
        {
          "type": "Redundancy",
          "value": 13.3
        }
      ]
    }
  ]

}
  

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


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