Data quality metrics extracted from 2fu3.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": "f25397e8b46dfc788532cc18cec5a6c4",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 108.820,
    "b": 156.195,
    "c": 51.362,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.10000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.000,2.700],
    "number_observations_unique": 35018,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.095
      },
      {
        "type": "I/SigI",
        "value": 16.400
      },
      {
        "type": "Completeness",
        "value": 99.800
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.75,2.70],
      "number_observations_unique": 1173,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.572
        }
      ]
    },
    {
      "resolution_limits": [2.80,2.75],
      "number_observations_unique": 1220,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.482
        }
      ]
    },
    {
      "resolution_limits": [2.85,2.80],
      "number_observations_unique": 1235,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.386
        }
      ]
    },
    {
      "resolution_limits": [2.91,2.85],
      "number_observations_unique": 1166,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.332
        }
      ]
    },
    {
      "resolution_limits": [2.97,2.91],
      "number_observations_unique": 1231,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.287
        }
      ]
    },
    {
      "resolution_limits": [3.04,2.97],
      "number_observations_unique": 1223,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.258
        }
      ]
    },
    {
      "resolution_limits": [3.12,3.04],
      "number_observations_unique": 1210,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.214
        }
      ]
    },
    {
      "resolution_limits": [3.20,3.12],
      "number_observations_unique": 1231,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.178
        }
      ]
    },
    {
      "resolution_limits": [3.30,3.20],
      "number_observations_unique": 1199,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.144
        }
      ]
    },
    {
      "resolution_limits": [3.40,3.30],
      "number_observations_unique": 1248,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.13
        }
      ]
    },
    {
      "resolution_limits": [3.52,3.40],
      "number_observations_unique": 1209,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.122
        }
      ]
    },
    {
      "resolution_limits": [3.66,3.52],
      "number_observations_unique": 1252,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.107
        }
      ]
    },
    {
      "resolution_limits": [3.83,3.66],
      "number_observations_unique": 1206,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.099
        }
      ]
    },
    {
      "resolution_limits": [4.03,3.83],
      "number_observations_unique": 1238,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.095
        }
      ]
    },
    {
      "resolution_limits": [4.29,4.03],
      "number_observations_unique": 1253,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.089
        }
      ]
    },
    {
      "resolution_limits": [4.62,4.29],
      "number_observations_unique": 1235,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.084
        }
      ]
    },
    {
      "resolution_limits": [5.08,4.62],
      "number_observations_unique": 1249,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.08
        }
      ]
    },
    {
      "resolution_limits": [5.81,5.08],
      "number_observations_unique": 1270,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.08
        }
      ]
    },
    {
      "resolution_limits": [7.32,5.81],
      "number_observations_unique": 1287,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.076
        }
      ]
    },
    {
      "resolution_limits": [50.00,7.32],
      "number_observations_unique": 1350,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.058
        }
      ]
    }
  ]

}
  

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


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