Data quality metrics extracted from 4ztp.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": "84efb10cdeb1e8cfe67f2b1e64a257ef",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 105.433,
    "b": 78.553,
    "c": 68.480,
    "alpha": 90.00,
    "beta": 92.25,
    "gamma": 90.00
  },
  "wavelengths": [1.03330],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,1.63],
    "number_observations_unique": 66122,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.056
      },
      {
        "type": "I/SigI",
        "value": 21.5
      },
      {
        "type": "Completeness",
        "value": 95.4
      },
      {
        "type": "Redundancy",
        "value": 3.9
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.66,1.63],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.440
        },
        {
          "type": "I/SigI",
          "value": 2.35
        },
        {
          "type": "Completeness",
          "value": 79.0
        },
        {
          "type": "Redundancy",
          "value": 3.1
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 50.000 1.660
High resolution limit [Å] 1.630 1.630
R(merge) 0.0560 0.4400
Completeness [%] 95.4 79.0
Multiplicity 3.9 3.1


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

Resolution [Å] R(merge) Completeness [%] Multiplicity
1.660-1.630 0.4400 79.0 3.1