Data quality metrics extracted from 5r1v.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": "544fb5ccb4c27c9f8dd23a2d2ee7243e",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 45.239,
    "b": 72.881,
    "c": 52.684,
    "alpha": 90.00,
    "beta": 109.43,
    "gamma": 90.00
  },
  "wavelengths": [0.82700],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [42.662,0.94],
    "number_observations": 1250230,
    "number_observations_unique": 190873,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.087
      },
      {
        "type": "R(meas)",
        "value": 0.094
      },
      {
        "type": "I/SigI",
        "value": 8.720
      },
      {
        "type": "Completeness",
        "value": 91.300
      },
      {
        "type": "Redundancy",
        "value": 6.546
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.00,0.94],
      "number_observations": 94515,
      "number_observations_unique": 33724,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.757
        },
        {
          "type": "R(meas)",
          "value": 1.986
        },
        {
          "type": "I/SigI",
          "value": 0.51
        },
        {
          "type": "Completeness",
          "value": 0.611
        },
        {
          "type": "Redundancy",
          "value": 2.80
        },
        {
          "type": "CC(1/2)",
          "value": 0.217
        }
      ]
    },
    {
      "resolution_limits": [1.07,1.00],
      "number_observations": 168470,
      "number_observations_unique": 31697,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.999
        },
        {
          "type": "R(meas)",
          "value": 1.096
        },
        {
          "type": "I/SigI",
          "value": 1.28
        },
        {
          "type": "Completeness",
          "value": 0.897
        },
        {
          "type": "Redundancy",
          "value": 5.32
        },
        {
          "type": "CC(1/2)",
          "value": 0.581
        }
      ]
    },
    {
      "resolution_limits": [1.15,1.07],
      "number_observations": 198085,
      "number_observations_unique": 29547,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.551
        },
        {
          "type": "R(meas)",
          "value": 0.595
        },
        {
          "type": "I/SigI",
          "value": 2.95
        },
        {
          "type": "Completeness",
          "value": 0.976
        },
        {
          "type": "Redundancy",
          "value": 6.70
        },
        {
          "type": "CC(1/2)",
          "value": 0.889
        }
      ]
    },
    {
      "resolution_limits": [1.26,1.15],
      "number_observations": 185227,
      "number_observations_unique": 27232,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.340
        },
        {
          "type": "R(meas)",
          "value": 0.367
        },
        {
          "type": "I/SigI",
          "value": 5.02
        },
        {
          "type": "Completeness",
          "value": 0.982
        },
        {
          "type": "Redundancy",
          "value": 6.80
        },
        {
          "type": "CC(1/2)",
          "value": 0.949
        }
      ]
    },
    {
      "resolution_limits": [1.41,1.26],
      "number_observations": 170085,
      "number_observations_unique": 24585,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.219
        },
        {
          "type": "R(meas)",
          "value": 0.237
        },
        {
          "type": "I/SigI",
          "value": 7.63
        },
        {
          "type": "Completeness",
          "value": 0.989
        },
        {
          "type": "Redundancy",
          "value": 6.92
        },
        {
          "type": "CC(1/2)",
          "value": 0.978
        }
      ]
    },
    {
      "resolution_limits": [1.63,1.41],
      "number_observations": 149515,
      "number_observations_unique": 21743,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.130
        },
        {
          "type": "R(meas)",
          "value": 0.141
        },
        {
          "type": "I/SigI",
          "value": 12.42
        },
        {
          "type": "Completeness",
          "value": 0.994
        },
        {
          "type": "Redundancy",
          "value": 6.88
        },
        {
          "type": "CC(1/2)",
          "value": 0.990
        }
      ]
    },
    {
      "resolution_limits": [1.99,1.63],
      "number_observations": 128265,
      "number_observations_unique": 18377,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.083
        },
        {
          "type": "R(meas)",
          "value": 0.090
        },
        {
          "type": "I/SigI",
          "value": 19.24
        },
        {
          "type": "Completeness",
          "value": 0.998
        },
        {
          "type": "Redundancy",
          "value": 6.98
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [2.81,1.99],
      "number_observations": 100363,
      "number_observations_unique": 14268,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.067
        },
        {
          "type": "R(meas)",
          "value": 0.073
        },
        {
          "type": "I/SigI",
          "value": 25.61
        },
        {
          "type": "Completeness",
          "value": 0.999
        },
        {
          "type": "Redundancy",
          "value": 7.03
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [50.00,2.81],
      "number_observations": 55705,
      "number_observations_unique": 7957,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.067
        },
        {
          "type": "R(meas)",
          "value": 0.072
        },
        {
          "type": "I/SigI",
          "value": 28.77
        },
        {
          "type": "Completeness",
          "value": 0.994
        },
        {
          "type": "Redundancy",
          "value": 7.00
        },
        {
          "type": "CC(1/2)",
          "value": 0.994
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 42.662 50.000 1.070
High resolution limit [Å] 0.940 2.810 1.000
R(merge) 0.0870 0.0670 0.9990
R(meas) 0.0940 0.0720 1.0960
CC(1/2) 0.997 0.994 0.581
Completeness [%] 91.3 1.0 0.9
Multiplicity 6.5 7.0 5.3


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

Resolution [Å] R(merge) R(meas) CC(1/2) Completeness [%] Multiplicity
50.000-2.810 0.0670 0.0720 0.994 1.0 7.0
2.810-1.990 0.0670 0.0730 0.996 1.0 7.0
1.990-1.630 0.0830 0.0900 0.995 1.0 7.0
1.630-1.410 0.1300 0.1410 0.990 1.0 6.9
1.410-1.260 0.2190 0.2370 0.978 1.0 6.9
1.260-1.150 0.3400 0.3670 0.949 1.0 6.8
1.150-1.070 0.5510 0.5950 0.889 1.0 6.7
1.070-1.000 0.9990 1.0960 0.581 0.9 5.3
1.000-0.940 1.7570 1.9860 0.217 0.6 2.8