Data quality metrics extracted from 2fon.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": "75f0942cfbd0a351103ba0d13a4e17f3",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 120.20,
    "b": 240.33,
    "c": 89.30,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [30.000,2.700],
    "number_observations_unique": 64138,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.092
      },
      {
        "type": "I/SigI",
        "value": 12.200
      },
      {
        "type": "Completeness",
        "value": 95.400
      },
      {
        "type": "Redundancy",
        "value": 6.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.77,2.70],
      "number_observations_unique": 4704,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.374
        }
      ]
    },
    {
      "resolution_limits": [2.84,2.77],
      "number_observations_unique": 4760,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.31
        }
      ]
    },
    {
      "resolution_limits": [2.93,2.84],
      "number_observations_unique": 4730,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.249
        }
      ]
    },
    {
      "resolution_limits": [3.02,2.93],
      "number_observations_unique": 4715,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.213
        }
      ]
    },
    {
      "resolution_limits": [3.13,3.02],
      "number_observations_unique": 4731,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.182
        }
      ]
    },
    {
      "resolution_limits": [3.25,3.13],
      "number_observations_unique": 4764,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.154
        }
      ]
    },
    {
      "resolution_limits": [3.40,3.25],
      "number_observations_unique": 4739,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.129
        }
      ]
    },
    {
      "resolution_limits": [3.58,3.40],
      "number_observations_unique": 3337,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.128
        }
      ]
    },
    {
      "resolution_limits": [3.80,3.58],
      "number_observations_unique": 3386,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.099
        }
      ]
    },
    {
      "resolution_limits": [4.10,3.80],
      "number_observations_unique": 4711,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.078
        }
      ]
    },
    {
      "resolution_limits": [4.51,4.10],
      "number_observations_unique": 4780,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.068
        }
      ]
    },
    {
      "resolution_limits": [5.16,4.51],
      "number_observations_unique": 4821,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.062
        }
      ]
    },
    {
      "resolution_limits": [6.49,5.16],
      "number_observations_unique": 4855,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.139
        }
      ]
    },
    {
      "resolution_limits": [30.00,6.49],
      "number_observations_unique": 5105,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.078
        }
      ]
    }
  ]

}
  

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


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