Data quality metrics extracted from 3zn5.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": "ad3209a7b481ef2cdb2dbf8e45463d1a",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 41.41,
    "b": 77.05,
    "c": 403.00,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.96900],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [42.16,2.36],
    "number_observations_unique": 54151,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.11
      },
      {
        "type": "I/SigI",
        "value": 7.50
      },
      {
        "type": "Completeness",
        "value": 99.1
      },
      {
        "type": "Redundancy",
        "value": 3.2
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.42,2.36],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.14
        },
        {
          "type": "I/SigI",
          "value": 1.30
        },
        {
          "type": "Completeness",
          "value": 99.6
        },
        {
          "type": "Redundancy",
          "value": 3.3
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 42.160 2.420
High resolution limit [Å] 2.360 2.360
R(merge) 0.1100 1.1400
Completeness [%] 99.1 99.6
Multiplicity 3.2 3.3


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

Resolution [Å] R(merge) Completeness [%] Multiplicity
2.420-2.360 1.1400 99.6 3.3