Data quality metrics extracted from 7mbf.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": "8a33fd5cd476187b591d61fe33d8d3c4",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 78.936,
    "b": 90.937,
    "c": 144.801,
    "alpha": 90.000,
    "beta": 93.529,
    "gamma": 90.000
  },
  "wavelengths": [0.97946],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.0,2.4],
    "number_observations_unique": 68275,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.214
      },
      {
        "type": "R(meas)",
        "value": 0.258
      },
      {
        "type": "R(pim)",
        "value": 0.143
      },
      {
        "type": "I/SigI",
        "value": 2.8
      },
      {
        "type": "Completeness",
        "value": 86.2
      },
      {
        "type": "Redundancy",
        "value": 2.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.966
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.49,2.40],
      "number_observations_unique": 3743,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.958
        },
        {
          "type": "R(meas)",
          "value": 1.215
        },
        {
          "type": "R(pim)",
          "value": 0.735
        },
        {
          "type": "I/SigI",
          "value": 0.58
        },
        {
          "type": "Completeness",
          "value": 47.6
        },
        {
          "type": "Redundancy",
          "value": 1.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.523
        }
      ]
    }
  ]

}
  

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


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