Data quality metrics extracted from 5rd8.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": "e909aae41c46e1a57649787437938091",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 45.202,
    "b": 72.978,
    "c": 52.357,
    "alpha": 90.00,
    "beta": 109.17,
    "gamma": 90.00
  },
  "wavelengths": [0.82700],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [39.360,0.98],
    "number_observations": 1167541,
    "number_observations_unique": 170022,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.051
      },
      {
        "type": "R(meas)",
        "value": 0.056
      },
      {
        "type": "I/SigI",
        "value": 13.780
      },
      {
        "type": "Completeness",
        "value": 96.700
      },
      {
        "type": "Redundancy",
        "value": 6.519
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.04,0.98],
      "number_observations": 123769,
      "number_observations_unique": 29883,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.992
        },
        {
          "type": "R(meas)",
          "value": 2.216
        },
        {
          "type": "I/SigI",
          "value": 0.69
        },
        {
          "type": "Completeness",
          "value": 0.809
        },
        {
          "type": "Redundancy",
          "value": 4.14
        },
        {
          "type": "CC(1/2)",
          "value": 0.294
        }
      ]
    },
    {
      "resolution_limits": [1.11,1.04],
      "number_observations": 186220,
      "number_observations_unique": 28076,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.962
        },
        {
          "type": "R(meas)",
          "value": 1.047
        },
        {
          "type": "I/SigI",
          "value": 1.80
        },
        {
          "type": "Completeness",
          "value": 0.999
        },
        {
          "type": "Redundancy",
          "value": 6.63
        },
        {
          "type": "CC(1/2)",
          "value": 0.712
        }
      ]
    },
    {
      "resolution_limits": [1.20,1.11],
      "number_observations": 176185,
      "number_observations_unique": 26159,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.466
        },
        {
          "type": "R(meas)",
          "value": 0.506
        },
        {
          "type": "I/SigI",
          "value": 3.94
        },
        {
          "type": "Completeness",
          "value": 0.999
        },
        {
          "type": "Redundancy",
          "value": 6.74
        },
        {
          "type": "CC(1/2)",
          "value": 0.915
        }
      ]
    },
    {
      "resolution_limits": [1.31,1.20],
      "number_observations": 164567,
      "number_observations_unique": 24011,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.291
        },
        {
          "type": "R(meas)",
          "value": 0.315
        },
        {
          "type": "I/SigI",
          "value": 6.39
        },
        {
          "type": "Completeness",
          "value": 0.999
        },
        {
          "type": "Redundancy",
          "value": 6.85
        },
        {
          "type": "CC(1/2)",
          "value": 0.965
        }
      ]
    },
    {
      "resolution_limits": [1.47,1.31],
      "number_observations": 148341,
      "number_observations_unique": 21818,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.167
        },
        {
          "type": "R(meas)",
          "value": 0.181
        },
        {
          "type": "I/SigI",
          "value": 11.17
        },
        {
          "type": "Completeness",
          "value": 0.999
        },
        {
          "type": "Redundancy",
          "value": 6.80
        },
        {
          "type": "CC(1/2)",
          "value": 0.988
        }
      ]
    },
    {
      "resolution_limits": [1.69,1.47],
      "number_observations": 127448,
      "number_observations_unique": 19247,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.092
        },
        {
          "type": "R(meas)",
          "value": 0.100
        },
        {
          "type": "I/SigI",
          "value": 20.02
        },
        {
          "type": "Completeness",
          "value": 0.999
        },
        {
          "type": "Redundancy",
          "value": 6.62
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [2.07,1.69],
      "number_observations": 109961,
      "number_observations_unique": 16259,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.050
        },
        {
          "type": "R(meas)",
          "value": 0.054
        },
        {
          "type": "I/SigI",
          "value": 34.85
        },
        {
          "type": "Completeness",
          "value": 0.998
        },
        {
          "type": "Redundancy",
          "value": 6.76
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [2.93,2.07],
      "number_observations": 85203,
      "number_observations_unique": 12633,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.036
        },
        {
          "type": "R(meas)",
          "value": 0.039
        },
        {
          "type": "I/SigI",
          "value": 46.65
        },
        {
          "type": "Completeness",
          "value": 0.997
        },
        {
          "type": "Redundancy",
          "value": 6.74
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [50.00,2.93],
      "number_observations": 45847,
      "number_observations_unique": 7055,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.031
        },
        {
          "type": "R(meas)",
          "value": 0.034
        },
        {
          "type": "I/SigI",
          "value": 52.50
        },
        {
          "type": "Completeness",
          "value": 0.979
        },
        {
          "type": "Redundancy",
          "value": 6.50
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 39.360 50.000 1.110
High resolution limit [Å] 0.980 2.930 1.040
R(merge) 0.0510 0.0310 0.9620
R(meas) 0.0560 0.0340 1.0470
CC(1/2) 0.999 0.999 0.712
Completeness [%] 96.7 1.0 1.0
Multiplicity 6.5 6.5 6.6


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

Resolution [Å] R(merge) R(meas) CC(1/2) Completeness [%] Multiplicity
50.000-2.930 0.0310 0.0340 0.999 1.0 6.5
2.930-2.070 0.0360 0.0390 0.999 1.0 6.7
2.070-1.690 0.0500 0.0540 0.998 1.0 6.8
1.690-1.470 0.0920 0.1000 0.995 1.0 6.6
1.470-1.310 0.1670 0.1810 0.988 1.0 6.8
1.310-1.200 0.2910 0.3150 0.965 1.0 6.9
1.200-1.110 0.4660 0.5060 0.915 1.0 6.7
1.110-1.040 0.9620 1.0470 0.712 1.0 6.6
1.040-0.980 1.9920 2.2160 0.294 0.8 4.1