Data quality metrics extracted from 4gne.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": "a3d26f8bcb1f98e26986afdb6f5882f9",
  "space_group_name": "P 65 2 2",
  "unit_cell": {
    "a": 57.20,
    "b": 57.20,
    "c": 107.44,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.97915],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.536,1.465],
    "number_observations_unique": 18490,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.085
      },
      {
        "type": "I/SigI",
        "value": 36.700
      },
      {
        "type": "Completeness",
        "value": 99.500
      },
      {
        "type": "Redundancy",
        "value": 39.700
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.540,1.470],
      "number_observations": 96987,
      "number_observations_unique": 2593,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.281
        },
        {
          "type": "R(meas)",
          "value": 0.293
        },
        {
          "type": "R(pim)",
          "value": 0.047
        },
        {
          "type": "I/SigI",
          "value": 2.600
        },
        {
          "type": "Completeness",
          "value": 98.500
        },
        {
          "type": "Redundancy",
          "value": 37.400
        }
      ]
    },
    {
      "resolution_limits": [1.640,1.540],
      "number_observations": 103407,
      "number_observations_unique": 2481,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.192
        },
        {
          "type": "R(meas)",
          "value": 0.203
        },
        {
          "type": "R(pim)",
          "value": 0.031
        },
        {
          "type": "I/SigI",
          "value": 3.700
        },
        {
          "type": "Completeness",
          "value": 99.600
        },
        {
          "type": "Redundancy",
          "value": 41.700
        }
      ]
    },
    {
      "resolution_limits": [1.750,1.640],
      "number_observations": 97411,
      "number_observations_unique": 2344,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.131
        },
        {
          "type": "R(meas)",
          "value": 0.141
        },
        {
          "type": "R(pim)",
          "value": 0.022
        },
        {
          "type": "I/SigI",
          "value": 5.300
        },
        {
          "type": "Completeness",
          "value": 99.700
        },
        {
          "type": "Redundancy",
          "value": 41.600
        }
      ]
    },
    {
      "resolution_limits": [1.890,1.750],
      "number_observations": 91449,
      "number_observations_unique": 2215,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.105
        },
        {
          "type": "R(meas)",
          "value": 0.116
        },
        {
          "type": "R(pim)",
          "value": 0.018
        },
        {
          "type": "I/SigI",
          "value": 6.200
        },
        {
          "type": "Completeness",
          "value": 99.900
        },
        {
          "type": "Redundancy",
          "value": 41.300
        }
      ]
    },
    {
      "resolution_limits": [2.070,1.890],
      "number_observations": 83688,
      "number_observations_unique": 2045,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.095
        },
        {
          "type": "R(meas)",
          "value": 0.106
        },
        {
          "type": "R(pim)",
          "value": 0.016
        },
        {
          "type": "I/SigI",
          "value": 6.700
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 40.900
        }
      ]
    },
    {
      "resolution_limits": [2.320,2.070],
      "number_observations": 75861,
      "number_observations_unique": 1867,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.078
        },
        {
          "type": "R(meas)",
          "value": 0.087
        },
        {
          "type": "R(pim)",
          "value": 0.013
        },
        {
          "type": "I/SigI",
          "value": 7.700
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 40.600
        }
      ]
    },
    {
      "resolution_limits": [2.670,2.320],
      "number_observations": 66186,
      "number_observations_unique": 1674,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.082
        },
        {
          "type": "R(meas)",
          "value": 0.091
        },
        {
          "type": "R(pim)",
          "value": 0.014
        },
        {
          "type": "I/SigI",
          "value": 7.100
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 39.500
        }
      ]
    },
    {
      "resolution_limits": [3.280,2.670],
      "number_observations": 55312,
      "number_observations_unique": 1444,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.090
        },
        {
          "type": "R(meas)",
          "value": 0.097
        },
        {
          "type": "R(pim)",
          "value": 0.015
        },
        {
          "type": "I/SigI",
          "value": 6.500
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 38.300
        }
      ]
    },
    {
      "resolution_limits": [4.630,3.280],
      "number_observations": 40324,
      "number_observations_unique": 1141,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.068
        },
        {
          "type": "R(meas)",
          "value": 0.074
        },
        {
          "type": "R(pim)",
          "value": 0.012
        },
        {
          "type": "I/SigI",
          "value": 8.300
        },
        {
          "type": "Completeness",
          "value": 99.600
        },
        {
          "type": "Redundancy",
          "value": 35.300
        }
      ]
    },
    {
      "resolution_limits": [36.417,4.630],
      "number_observations": 22729,
      "number_observations_unique": 686,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.066
        },
        {
          "type": "R(meas)",
          "value": 0.076
        },
        {
          "type": "R(pim)",
          "value": 0.013
        },
        {
          "type": "I/SigI",
          "value": 8.800
        },
        {
          "type": "Completeness",
          "value": 96.900
        },
        {
          "type": "Redundancy",
          "value": 33.100
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 49.536 36.417 1.640
High resolution limit [Å] 1.465 4.630 1.540
R(merge) 0.0850 0.0660 0.1920
R(meas) - 0.0760 0.2030
R(pim) - 0.0130 0.0310
Completeness [%] 99.5 96.9 99.6
Multiplicity 39.7 33.1 41.7


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

Resolution [Å] R(merge) R(meas) R(pim) Completeness [%] Multiplicity
36.417-4.630 0.0660 0.0760 0.0130 96.9 33.1
4.630-3.280 0.0680 0.0740 0.0120 99.6 35.3
3.280-2.670 0.0900 0.0970 0.0150 100.0 38.3
2.670-2.320 0.0820 0.0910 0.0140 100.0 39.5
2.320-2.070 0.0780 0.0870 0.0130 100.0 40.6
2.070-1.890 0.0950 0.1060 0.0160 100.0 40.9
1.890-1.750 0.1050 0.1160 0.0180 99.9 41.3
1.750-1.640 0.1310 0.1410 0.0220 99.7 41.6
1.640-1.540 0.1920 0.2030 0.0310 99.6 41.7
1.540-1.470 0.2810 0.2930 0.0470 98.5 37.4