Data quality metrics extracted from 5r3o.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": "c3af8f40a27a0703c3f80e8bda3c5a2c",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 45.222,
    "b": 73.313,
    "c": 52.472,
    "alpha": 90.00,
    "beta": 109.04,
    "gamma": 90.00
  },
  "wavelengths": [0.82700],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [42.749,1.22],
    "number_observations_unique": 96223,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 11.470
      },
      {
        "type": "Completeness",
        "value": 99.400
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.29,1.22],
      "number_observations": 101987,
      "number_observations_unique": 15632,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.408
        },
        {
          "type": "R(meas)",
          "value": 1.527
        },
        {
          "type": "I/SigI",
          "value": 0.83
        },
        {
          "type": "Completeness",
          "value": 0.974
        },
        {
          "type": "Redundancy",
          "value": 6.52
        },
        {
          "type": "CC(1/2)",
          "value": 0.337
        }
      ]
    },
    {
      "resolution_limits": [1.38,1.29],
      "number_observations": 99726,
      "number_observations_unique": 14652,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.009
        },
        {
          "type": "R(meas)",
          "value": 1.095
        },
        {
          "type": "I/SigI",
          "value": 1.38
        },
        {
          "type": "Completeness",
          "value": 0.999
        },
        {
          "type": "Redundancy",
          "value": 6.81
        },
        {
          "type": "CC(1/2)",
          "value": 0.556
        }
      ]
    },
    {
      "resolution_limits": [1.49,1.38],
      "number_observations": 88910,
      "number_observations_unique": 13655,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.662
        },
        {
          "type": "R(meas)",
          "value": 0.721
        },
        {
          "type": "I/SigI",
          "value": 2.46
        },
        {
          "type": "Completeness",
          "value": 0.997
        },
        {
          "type": "Redundancy",
          "value": 6.51
        },
        {
          "type": "CC(1/2)",
          "value": 0.822
        }
      ]
    },
    {
      "resolution_limits": [1.63,1.49],
      "number_observations": 78553,
      "number_observations_unique": 12610,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.357
        },
        {
          "type": "R(meas)",
          "value": 0.391
        },
        {
          "type": "I/SigI",
          "value": 4.76
        },
        {
          "type": "Completeness",
          "value": 0.995
        },
        {
          "type": "Redundancy",
          "value": 6.23
        },
        {
          "type": "CC(1/2)",
          "value": 0.953
        }
      ]
    },
    {
      "resolution_limits": [1.82,1.63],
      "number_observations": 74752,
      "number_observations_unique": 11390,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.198
        },
        {
          "type": "R(meas)",
          "value": 0.215
        },
        {
          "type": "I/SigI",
          "value": 10.09
        },
        {
          "type": "Completeness",
          "value": 0.995
        },
        {
          "type": "Redundancy",
          "value": 6.56
        },
        {
          "type": "CC(1/2)",
          "value": 0.986
        }
      ]
    },
    {
      "resolution_limits": [2.11,1.82],
      "number_observations": 70015,
      "number_observations_unique": 10085,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.113
        },
        {
          "type": "R(meas)",
          "value": 0.122
        },
        {
          "type": "I/SigI",
          "value": 19.57
        },
        {
          "type": "Completeness",
          "value": 0.998
        },
        {
          "type": "Redundancy",
          "value": 6.94
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [2.58,2.11],
      "number_observations": 58817,
      "number_observations_unique": 8511,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.079
        },
        {
          "type": "R(meas)",
          "value": 0.085
        },
        {
          "type": "I/SigI",
          "value": 27.95
        },
        {
          "type": "Completeness",
          "value": 0.999
        },
        {
          "type": "Redundancy",
          "value": 6.91
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [3.64,2.58],
      "number_observations": 46384,
      "number_observations_unique": 6618,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.054
        },
        {
          "type": "R(meas)",
          "value": 0.059
        },
        {
          "type": "I/SigI",
          "value": 38.12
        },
        {
          "type": "Completeness",
          "value": 0.998
        },
        {
          "type": "Redundancy",
          "value": 7.01
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [50.00,3.64],
      "number_observations": 25808,
      "number_observations_unique": 3723,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.040
        },
        {
          "type": "R(meas)",
          "value": 0.043
        },
        {
          "type": "I/SigI",
          "value": 47.87
        },
        {
          "type": "Completeness",
          "value": 0.996
        },
        {
          "type": "Redundancy",
          "value": 6.93
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 42.749 50.000 1.380
High resolution limit [Å] 1.220 3.640 1.290
R(merge) - 0.0400 1.0090
R(meas) - 0.0430 1.0950
CC(1/2) - 0.999 0.556
Completeness [%] 99.4 1.0 1.0
Multiplicity - 6.9 6.8


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

Resolution [Å] R(merge) R(meas) CC(1/2) Completeness [%] Multiplicity
50.000-3.640 0.0400 0.0430 0.999 1.0 6.9
3.640-2.580 0.0540 0.0590 0.999 1.0 7.0
2.580-2.110 0.0790 0.0850 0.997 1.0 6.9
2.110-1.820 0.1130 0.1220 0.995 1.0 6.9
1.820-1.630 0.1980 0.2150 0.986 1.0 6.6
1.630-1.490 0.3570 0.3910 0.953 1.0 6.2
1.490-1.380 0.6620 0.7210 0.822 1.0 6.5
1.380-1.290 1.0090 1.0950 0.556 1.0 6.8
1.290-1.220 1.4080 1.5270 0.337 1.0 6.5