Data quality metrics extracted from 2xh7.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": "64ec4aba34165bb2715c04d493834809",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 61.973,
    "b": 62.000,
    "c": 64.320,
    "alpha": 67.89,
    "beta": 78.33,
    "gamma": 80.60
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.00,1.80],
    "number_observations_unique": 73622,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.15
      },
      {
        "type": "I/SigI",
        "value": 11.43
      },
      {
        "type": "Completeness",
        "value": 91.3
      },
      {
        "type": "Redundancy",
        "value": 1.81
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.91,1.80],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.68
        },
        {
          "type": "I/SigI",
          "value": 3.12
        },
        {
          "type": "Completeness",
          "value": 89.6
        },
        {
          "type": "Redundancy",
          "value": 1.75
        }
      ]
    }
  ]

}
  

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


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