Data quality metrics extracted from 1alx.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": "77a2146124c1f7afc8b60b2769078db5",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 14.907,
    "b": 26.014,
    "c": 31.911,
    "alpha": 90.00,
    "beta": 92.03,
    "gamma": 90.00
  },
  "wavelengths": [1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [100.000,1.250],
    "number_observations_unique": 7726,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 85.4100
      },
      {
        "type": "Completeness",
        "value": 99.9
      },
      {
        "type": "Redundancy",
        "value": 1.000
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.24,1.20],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 35.530
        },
        {
          "type": "Completeness",
          "value": 99.0
        },
        {
          "type": "Redundancy",
          "value": 1.00
        }
      ]
    }
  ]

}
  

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


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