Data quality metrics extracted from 6sff.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": "befdffb236cdb25e9f7041d929994ec0",
  "space_group_name": "I 41",
  "unit_cell": {
    "a": 85.876,
    "b": 85.876,
    "c": 107.671,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.03320],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [67.41,2.4],
    "number_observations_unique": 15233,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.125
      },
      {
        "type": "I/SigI",
        "value": 12.23
      },
      {
        "type": "Completeness",
        "value": 99.7
      },
      {
        "type": "Redundancy",
        "value": 8.11
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [67.41,7.17],
      "number_observations_unique": 592,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.037
        },
        {
          "type": "I/SigI",
          "value": 47.82
        },
        {
          "type": "Completeness",
          "value": 100
        },
        {
          "type": "Redundancy",
          "value": 8.15
        },
        {
          "type": "CC(1/2)",
          "value": 1.00
        }
      ]
    },
    {
      "resolution_limits": [7.17,5.08],
      "number_observations_unique": 1045,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.062
        },
        {
          "type": "I/SigI",
          "value": 32.63
        },
        {
          "type": "Completeness",
          "value": 99.9
        },
        {
          "type": "Redundancy",
          "value": 8.34
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [5.08,4.15],
      "number_observations_unique": 1359,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.067
        },
        {
          "type": "I/SigI",
          "value": 29.95
        },
        {
          "type": "Completeness",
          "value": 100
        },
        {
          "type": "Redundancy",
          "value": 8.18
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [4.15,3.60],
      "number_observations_unique": 1583,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.098
        },
        {
          "type": "I/SigI",
          "value": 20.59
        },
        {
          "type": "Completeness",
          "value": 100
        },
        {
          "type": "Redundancy",
          "value": 8.22
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [3.60,3.22],
      "number_observations_unique": 1795,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.155
        },
        {
          "type": "I/SigI",
          "value": 13.26
        },
        {
          "type": "Completeness",
          "value": 100
        },
        {
          "type": "Redundancy",
          "value": 8.37
        },
        {
          "type": "CC(1/2)",
          "value": 0.992
        }
      ]
    },
    {
      "resolution_limits": [3.22,2.94],
      "number_observations_unique": 1991,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.313
        },
        {
          "type": "I/SigI",
          "value": 6.38
        },
        {
          "type": "Completeness",
          "value": 100
        },
        {
          "type": "Redundancy",
          "value": 8.33
        },
        {
          "type": "CC(1/2)",
          "value": 0.974
        }
      ]
    },
    {
      "resolution_limits": [2.94,2.72],
      "number_observations_unique": 2146,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.577
        },
        {
          "type": "I/SigI",
          "value": 1.85
        },
        {
          "type": "Completeness",
          "value": 99.9
        },
        {
          "type": "Redundancy",
          "value": 8.28
        },
        {
          "type": "CC(1/2)",
          "value": 0.914
        }
      ]
    },
    {
      "resolution_limits": [2.72,2.55],
      "number_observations_unique": 2303,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.99
        },
        {
          "type": "I/SigI",
          "value": 0.97
        },
        {
          "type": "Completeness",
          "value": 99.9
        },
        {
          "type": "Redundancy",
          "value": 8.34
        },
        {
          "type": "CC(1/2)",
          "value": 0.811
        }
      ]
    },
    {
      "resolution_limits": [2.55,2.40],
      "number_observations_unique": 2419,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.551
        },
        {
          "type": "Completeness",
          "value": 98.5
        },
        {
          "type": "Redundancy",
          "value": 7.16
        },
        {
          "type": "CC(1/2)",
          "value": 0.555
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 67.410 7.170 2.550
High resolution limit [Å] 2.400 5.080 2.400
R(meas) 0.1250 0.0620 1.5510
CC(1/2) 0.998 0.998 0.555
Completeness [%] 99.7 99.9 98.5
Multiplicity 8.1 8.3 7.2


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

Resolution [Å] R(meas) CC(1/2) Completeness [%] Multiplicity
67.410-7.170 0.0370 1.000 100.0 8.2
7.170-5.080 0.0620 0.998 99.9 8.3
5.080-4.150 0.0670 0.998 100.0 8.2
4.150-3.600 0.0980 0.997 100.0 8.2
3.600-3.220 0.1550 0.992 100.0 8.4
3.220-2.940 0.3130 0.974 100.0 8.3
2.940-2.720 0.5770 0.914 99.9 8.3
2.720-2.550 0.9900 0.811 99.9 8.3
2.550-2.400 1.5510 0.555 98.5 7.2