Data quality metrics extracted from 5qzu.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": "a65c2dc2cf5b72d0a3bf619937fce56c",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 88.956,
    "b": 81.943,
    "c": 93.503,
    "alpha": 90.00,
    "beta": 108.39,
    "gamma": 90.00
  },
  "wavelengths": [0.82700],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [44.740,1.54],
    "number_observations": 636575,
    "number_observations_unique": 86980,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.065
      },
      {
        "type": "R(meas)",
        "value": 0.070
      },
      {
        "type": "I/SigI",
        "value": 11.060
      },
      {
        "type": "Completeness",
        "value": 98.300
      },
      {
        "type": "Redundancy",
        "value": 6.935
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.64,1.54],
      "number_observations": 97903,
      "number_observations_unique": 15056,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.000
        },
        {
          "type": "R(meas)",
          "value": 3.238
        },
        {
          "type": "I/SigI",
          "value": 0.28
        },
        {
          "type": "Completeness",
          "value": 0.940
        },
        {
          "type": "Redundancy",
          "value": 6.50
        },
        {
          "type": "CC(1/2)",
          "value": 0.264
        }
      ]
    },
    {
      "resolution_limits": [1.75,1.64],
      "number_observations": 97628,
      "number_observations_unique": 14091,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.532
        },
        {
          "type": "R(meas)",
          "value": 1.652
        },
        {
          "type": "I/SigI",
          "value": 0.72
        },
        {
          "type": "Completeness",
          "value": 0.984
        },
        {
          "type": "Redundancy",
          "value": 6.93
        },
        {
          "type": "CC(1/2)",
          "value": 0.613
        }
      ]
    },
    {
      "resolution_limits": [1.89,1.75],
      "number_observations": 90543,
      "number_observations_unique": 13167,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.752
        },
        {
          "type": "R(meas)",
          "value": 0.812
        },
        {
          "type": "I/SigI",
          "value": 1.75
        },
        {
          "type": "Completeness",
          "value": 0.988
        },
        {
          "type": "Redundancy",
          "value": 6.88
        },
        {
          "type": "CC(1/2)",
          "value": 0.858
        }
      ]
    },
    {
      "resolution_limits": [2.07,1.89],
      "number_observations": 82593,
      "number_observations_unique": 12126,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.327
        },
        {
          "type": "R(meas)",
          "value": 0.354
        },
        {
          "type": "I/SigI",
          "value": 4.49
        },
        {
          "type": "Completeness",
          "value": 0.991
        },
        {
          "type": "Redundancy",
          "value": 6.81
        },
        {
          "type": "CC(1/2)",
          "value": 0.970
        }
      ]
    },
    {
      "resolution_limits": [2.31,2.07],
      "number_observations": 75114,
      "number_observations_unique": 10966,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.158
        },
        {
          "type": "R(meas)",
          "value": 0.171
        },
        {
          "type": "I/SigI",
          "value": 9.67
        },
        {
          "type": "Completeness",
          "value": 0.995
        },
        {
          "type": "Redundancy",
          "value": 6.85
        },
        {
          "type": "CC(1/2)",
          "value": 0.991
        }
      ]
    },
    {
      "resolution_limits": [2.67,2.31],
      "number_observations": 67641,
      "number_observations_unique": 9692,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.093
        },
        {
          "type": "R(meas)",
          "value": 0.101
        },
        {
          "type": "I/SigI",
          "value": 17.44
        },
        {
          "type": "Completeness",
          "value": 0.997
        },
        {
          "type": "Redundancy",
          "value": 6.98
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [3.27,2.67],
      "number_observations": 56312,
      "number_observations_unique": 8229,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.059
        },
        {
          "type": "R(meas)",
          "value": 0.064
        },
        {
          "type": "I/SigI",
          "value": 28.14
        },
        {
          "type": "Completeness",
          "value": 0.998
        },
        {
          "type": "Redundancy",
          "value": 6.84
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [4.61,3.27],
      "number_observations": 44099,
      "number_observations_unique": 6400,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.042
        },
        {
          "type": "R(meas)",
          "value": 0.045
        },
        {
          "type": "I/SigI",
          "value": 40.96
        },
        {
          "type": "Completeness",
          "value": 0.997
        },
        {
          "type": "Redundancy",
          "value": 6.89
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [50.00,4.61],
      "number_observations": 24742,
      "number_observations_unique": 3610,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.039
        },
        {
          "type": "R(meas)",
          "value": 0.043
        },
        {
          "type": "I/SigI",
          "value": 44.17
        },
        {
          "type": "Completeness",
          "value": 0.993
        },
        {
          "type": "Redundancy",
          "value": 6.85
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 44.740 50.000 1.750
High resolution limit [Å] 1.540 4.610 1.640
R(merge) 0.0650 0.0390 1.5320
R(meas) 0.0700 0.0430 1.6520
CC(1/2) 0.999 0.998 0.613
Completeness [%] 98.3 1.0 1.0
Multiplicity 6.9 6.9 6.9


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

Resolution [Å] R(merge) R(meas) CC(1/2) Completeness [%] Multiplicity
50.000-4.610 0.0390 0.0430 0.998 1.0 6.9
4.610-3.270 0.0420 0.0450 0.999 1.0 6.9
3.270-2.670 0.0590 0.0640 0.998 1.0 6.8
2.670-2.310 0.0930 0.1010 0.996 1.0 7.0
2.310-2.070 0.1580 0.1710 0.991 1.0 6.9
2.070-1.890 0.3270 0.3540 0.970 1.0 6.8
1.890-1.750 0.7520 0.8120 0.858 1.0 6.9
1.750-1.640 1.5320 1.6520 0.613 1.0 6.9
1.640-1.540 3.0000 3.2380 0.264 0.9 6.5