Data quality metrics extracted from 3vr1.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": "fa2504fa5a637d87e881d1502b88a98c",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 80.202,
    "b": 83.461,
    "c": 114.245,
    "alpha": 72.98,
    "beta": 74.18,
    "gamma": 89.78
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.0,3.0],
    "number_observations_unique": 52309,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.078
      },
      {
        "type": "I/SigI",
        "value": 7.9
      },
      {
        "type": "Completeness",
        "value": 96.6
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.12,3.02],
      "number_observations_unique": 5293,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 92.5
        }
      ]
    },
    {
      "resolution_limits": [3.24,3.12],
      "number_observations_unique": 5133,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.4
        }
      ]
    },
    {
      "resolution_limits": [3.37,3.24],
      "number_observations_unique": 4920,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.3
        }
      ]
    },
    {
      "resolution_limits": [3.56,3.37],
      "number_observations_unique": 5859,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.3
        }
      ]
    },
    {
      "resolution_limits": [3.79,3.56],
      "number_observations_unique": 5538,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.1
        }
      ]
    },
    {
      "resolution_limits": [4.07,3.79],
      "number_observations_unique": 5185,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.2
        }
      ]
    },
    {
      "resolution_limits": [4.51,4.07],
      "number_observations_unique": 5779,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.0
        }
      ]
    },
    {
      "resolution_limits": [5.12,4.51],
      "number_observations_unique": 5116,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 96.5
        }
      ]
    },
    {
      "resolution_limits": [6.52,5.12],
      "number_observations_unique": 5761,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 94.4
        }
      ]
    },
    {
      "resolution_limits": [50,6.52],
      "number_observations_unique": 5591,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 98.8
        }
      ]
    }
  ]

}
  

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


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