Data quality metrics extracted from 1z4z.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": "460b0a9b2bdaa65e4f7808eae82c8df6",
  "space_group_name": "P 61 2 2",
  "unit_cell": {
    "a": 137.921,
    "b": 137.921,
    "c": 184.783,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.99990],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.00,2.50],
    "number_observations_unique": 35941,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.078
      },
      {
        "type": "Completeness",
        "value": 98.300
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.59,2.50],
      "number_observations": 3288,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.411
        }
      ]
    },
    {
      "resolution_limits": [2.69,2.59],
      "number_observations": 3410,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.346
        }
      ]
    },
    {
      "resolution_limits": [2.82,2.69],
      "number_observations": 3535,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.243
        }
      ]
    },
    {
      "resolution_limits": [2.96,2.82],
      "number_observations": 3574,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.186
        }
      ]
    },
    {
      "resolution_limits": [3.15,2.96],
      "number_observations": 3596,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.136
        }
      ]
    },
    {
      "resolution_limits": [3.39,3.15],
      "number_observations": 3618,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.098
        }
      ]
    },
    {
      "resolution_limits": [3.73,3.39],
      "number_observations": 3643,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.083
        }
      ]
    },
    {
      "resolution_limits": [4.27,3.73],
      "number_observations": 3659,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.059
        }
      ]
    },
    {
      "resolution_limits": [5.38,4.27],
      "number_observations": 3718,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.044
        }
      ]
    },
    {
      "resolution_limits": [50.00,5.38],
      "number_observations": 3900,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.041
        }
      ]
    }
  ]

}
  

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


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