Data quality metrics extracted from 5dgf.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": "d1f4d834cf58427e5bb57d7cf4d2b860",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 435.58,
    "b": 287.33,
    "c": 303.82,
    "alpha": 90.00,
    "beta": 98.95,
    "gamma": 90.00
  },
  "wavelengths": [1.14800],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [99.535,3.300],
    "number_observations": 8339030,
    "number_observations_unique": 1103604,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.590
      },
      {
        "type": "R(meas)",
        "value": 0.625
      },
      {
        "type": "I/SigI",
        "value": 6.000
      },
      {
        "type": "Completeness",
        "value": 100.000
      },
      {
        "type": "Redundancy",
        "value": 7.6
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.400,3.300],
      "number_observations": 588417,
      "number_observations_unique": 94195,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.815
        },
        {
          "type": "R(meas)",
          "value": 3.061
        },
        {
          "type": "I/SigI",
          "value": 0.990
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [3.500,3.400],
      "number_observations": 548087,
      "number_observations_unique": 83865,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.050
        },
        {
          "type": "R(meas)",
          "value": 2.220
        },
        {
          "type": "I/SigI",
          "value": 1.280
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [4.000,3.500],
      "number_observations": 1946006,
      "number_observations_unique": 304671,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.107
        },
        {
          "type": "R(meas)",
          "value": 1.202
        },
        {
          "type": "I/SigI",
          "value": 2.290
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [5.000,4.000],
      "number_observations": 1930869,
      "number_observations_unique": 302143,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.441
        },
        {
          "type": "R(meas)",
          "value": 0.479
        },
        {
          "type": "I/SigI",
          "value": 5.410
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [10.000,5.000],
      "number_observations": 2800549,
      "number_observations_unique": 278422,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.724
        },
        {
          "type": "R(meas)",
          "value": 0.756
        },
        {
          "type": "I/SigI",
          "value": 11.150
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [50.000,10.000],
      "number_observations": 522876,
      "number_observations_unique": 40010,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.240
        },
        {
          "type": "R(meas)",
          "value": 0.250
        },
        {
          "type": "I/SigI",
          "value": 24.460
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [75.000,50.000],
      "number_observations": 2038,
      "number_observations_unique": 242,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.078
        },
        {
          "type": "R(meas)",
          "value": 0.085
        },
        {
          "type": "I/SigI",
          "value": 28.780
        },
        {
          "type": "Completeness",
          "value": 98.800
        }
      ]
    },
    {
      "resolution_limits": [99.535,75.000],
      "number_observations": 188,
      "number_observations_unique": 56,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.069
        },
        {
          "type": "R(meas)",
          "value": 0.084
        },
        {
          "type": "I/SigI",
          "value": 14.180
        },
        {
          "type": "Completeness",
          "value": 50.900
        }
      ]
    }
  ]

}
  

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


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