Data quality metrics extracted from 1vlp.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": "f02678b7f21b818d736e64ef9aea6a5a",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 54.406,
    "b": 83.103,
    "c": 107.237,
    "alpha": 97.35,
    "beta": 95.67,
    "gamma": 97.99
  },
  "wavelengths": [0.96860,1.03320,0.97980],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.00,1.75],
    "number_observations_unique": 177740,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.075
      },
      {
        "type": "I/SigI",
        "value": 18.09
      },
      {
        "type": "Completeness",
        "value": 96.81
      },
      {
        "type": "Redundancy",
        "value": 3.79
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.81,1.75],
      "number_observations_unique": 16630,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.451
        },
        {
          "type": "I/SigI",
          "value": 1.64
        },
        {
          "type": "Completeness",
          "value": 90.05
        },
        {
          "type": "Redundancy",
          "value": 2.23
        }
      ]
    }
  ]

}
  

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


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