Data quality metrics extracted from 7g5z.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": "9bcb84a256e7bfe76e23d77ec818322d",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 83.670,
    "b": 91.463,
    "c": 119.489,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.99999],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [72.63,1.440],
    "number_observations": 1091322,
    "number_observations_unique": 165728,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.095
      },
      {
        "type": "R(meas)",
        "value": 0.103
      },
      {
        "type": "I/SigI",
        "value": 12.000
      },
      {
        "type": "Completeness",
        "value": 100.000
      },
      {
        "type": "Redundancy",
        "value": 6.585
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.480,1.440],
      "number_observations": 79756,
      "number_observations_unique": 12142,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.730
        },
        {
          "type": "R(meas)",
          "value": 2.966
        },
        {
          "type": "I/SigI",
          "value": 0.680
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.569
        },
        {
          "type": "CC(1/2)",
          "value": 0.254
        }
      ]
    },
    {
      "resolution_limits": [1.520,1.480],
      "number_observations": 73878,
      "number_observations_unique": 11818,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.327
        },
        {
          "type": "R(meas)",
          "value": 2.540
        },
        {
          "type": "I/SigI",
          "value": 0.820
        },
        {
          "type": "Completeness",
          "value": 99.900
        },
        {
          "type": "Redundancy",
          "value": 6.251
        },
        {
          "type": "CC(1/2)",
          "value": 0.319
        }
      ]
    },
    {
      "resolution_limits": [1.560,1.520],
      "number_observations": 75615,
      "number_observations_unique": 11517,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.656
        },
        {
          "type": "R(meas)",
          "value": 1.800
        },
        {
          "type": "I/SigI",
          "value": 1.190
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.566
        },
        {
          "type": "CC(1/2)",
          "value": 0.468
        }
      ]
    },
    {
      "resolution_limits": [1.610,1.560],
      "number_observations": 76511,
      "number_observations_unique": 11233,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.293
        },
        {
          "type": "R(meas)",
          "value": 1.401
        },
        {
          "type": "I/SigI",
          "value": 1.580
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.811
        },
        {
          "type": "CC(1/2)",
          "value": 0.591
        }
      ]
    },
    {
      "resolution_limits": [1.660,1.610],
      "number_observations": 72995,
      "number_observations_unique": 10827,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.017
        },
        {
          "type": "R(meas)",
          "value": 1.103
        },
        {
          "type": "I/SigI",
          "value": 2.040
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.742
        },
        {
          "type": "CC(1/2)",
          "value": 0.689
        }
      ]
    },
    {
      "resolution_limits": [1.720,1.660],
      "number_observations": 69609,
      "number_observations_unique": 10517,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.817
        },
        {
          "type": "R(meas)",
          "value": 0.888
        },
        {
          "type": "I/SigI",
          "value": 2.560
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.619
        },
        {
          "type": "CC(1/2)",
          "value": 0.775
        }
      ]
    },
    {
      "resolution_limits": [1.790,1.720],
      "number_observations": 63661,
      "number_observations_unique": 10147,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.571
        },
        {
          "type": "R(meas)",
          "value": 0.623
        },
        {
          "type": "I/SigI",
          "value": 3.610
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.274
        },
        {
          "type": "CC(1/2)",
          "value": 0.879
        }
      ]
    },
    {
      "resolution_limits": [1.860,1.790],
      "number_observations": 64525,
      "number_observations_unique": 9782,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.421
        },
        {
          "type": "R(meas)",
          "value": 0.457
        },
        {
          "type": "I/SigI",
          "value": 5.000
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.596
        },
        {
          "type": "CC(1/2)",
          "value": 0.928
        }
      ]
    },
    {
      "resolution_limits": [1.940,1.860],
      "number_observations": 64583,
      "number_observations_unique": 9374,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.306
        },
        {
          "type": "R(meas)",
          "value": 0.331
        },
        {
          "type": "I/SigI",
          "value": 6.900
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.890
        },
        {
          "type": "CC(1/2)",
          "value": 0.961
        }
      ]
    },
    {
      "resolution_limits": [2.040,1.940],
      "number_observations": 61352,
      "number_observations_unique": 8982,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.227
        },
        {
          "type": "R(meas)",
          "value": 0.246
        },
        {
          "type": "I/SigI",
          "value": 9.090
        },
        {
          "type": "Completeness",
          "value": 99.900
        },
        {
          "type": "Redundancy",
          "value": 6.831
        },
        {
          "type": "CC(1/2)",
          "value": 0.978
        }
      ]
    },
    {
      "resolution_limits": [2.150,2.040],
      "number_observations": 57705,
      "number_observations_unique": 8559,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.164
        },
        {
          "type": "R(meas)",
          "value": 0.178
        },
        {
          "type": "I/SigI",
          "value": 12.220
        },
        {
          "type": "Completeness",
          "value": 99.900
        },
        {
          "type": "Redundancy",
          "value": 6.742
        },
        {
          "type": "CC(1/2)",
          "value": 0.987
        }
      ]
    },
    {
      "resolution_limits": [2.280,2.150],
      "number_observations": 50863,
      "number_observations_unique": 8090,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.125
        },
        {
          "type": "R(meas)",
          "value": 0.136
        },
        {
          "type": "I/SigI",
          "value": 15.310
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.287
        },
        {
          "type": "CC(1/2)",
          "value": 0.992
        }
      ]
    },
    {
      "resolution_limits": [2.430,2.280],
      "number_observations": 51540,
      "number_observations_unique": 7645,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.097
        },
        {
          "type": "R(meas)",
          "value": 0.105
        },
        {
          "type": "I/SigI",
          "value": 19.400
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.742
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [2.630,2.430],
      "number_observations": 48850,
      "number_observations_unique": 7122,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.080
        },
        {
          "type": "R(meas)",
          "value": 0.087
        },
        {
          "type": "I/SigI",
          "value": 23.250
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.859
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [2.880,2.630],
      "number_observations": 43802,
      "number_observations_unique": 6580,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.062
        },
        {
          "type": "R(meas)",
          "value": 0.067
        },
        {
          "type": "I/SigI",
          "value": 28.350
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.657
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [3.220,2.880],
      "number_observations": 36851,
      "number_observations_unique": 5956,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.049
        },
        {
          "type": "R(meas)",
          "value": 0.053
        },
        {
          "type": "I/SigI",
          "value": 32.910
        },
        {
          "type": "Completeness",
          "value": 99.900
        },
        {
          "type": "Redundancy",
          "value": 6.187
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [3.720,3.220],
      "number_observations": 34165,
      "number_observations_unique": 5291,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.035
        },
        {
          "type": "R(meas)",
          "value": 0.038
        },
        {
          "type": "I/SigI",
          "value": 42.260
        },
        {
          "type": "Completeness",
          "value": 99.900
        },
        {
          "type": "Redundancy",
          "value": 6.457
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [4.550,3.720],
      "number_observations": 30268,
      "number_observations_unique": 4532,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.028
        },
        {
          "type": "R(meas)",
          "value": 0.031
        },
        {
          "type": "I/SigI",
          "value": 50.500
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 6.679
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [6.440,4.550],
      "number_observations": 21683,
      "number_observations_unique": 3545,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.026
        },
        {
          "type": "R(meas)",
          "value": 0.029
        },
        {
          "type": "I/SigI",
          "value": 48.670
        },
        {
          "type": "Completeness",
          "value": 99.900
        },
        {
          "type": "Redundancy",
          "value": 6.117
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [72.630,6.440],
      "number_observations": 13110,
      "number_observations_unique": 2069,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.024
        },
        {
          "type": "R(meas)",
          "value": 0.026
        },
        {
          "type": "I/SigI",
          "value": 52.640
        },
        {
          "type": "Completeness",
          "value": 99.700
        },
        {
          "type": "Redundancy",
          "value": 6.336
        },
        {
          "type": "CC(1/2)",
          "value": 1.000
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 72.630 72.630 1.520
High resolution limit [Å] 1.440 6.440 1.480
R(merge) 0.0950 0.0240 2.3270
R(meas) 0.1030 0.0260 2.5400
CC(1/2) 0.999 1.000 0.319
Completeness [%] 100.0 99.7 99.9
Multiplicity 6.6 6.3 6.3


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

Resolution [Å] R(merge) R(meas) CC(1/2) Completeness [%] Multiplicity
72.630-6.440 0.0240 0.0260 1.000 99.7 6.3
6.440-4.550 0.0260 0.0290 0.999 99.9 6.1
4.550-3.720 0.0280 0.0310 0.999 100.0 6.7
3.720-3.220 0.0350 0.0380 0.999 99.9 6.5
3.220-2.880 0.0490 0.0530 0.998 99.9 6.2
2.880-2.630 0.0620 0.0670 0.998 100.0 6.7
2.630-2.430 0.0800 0.0870 0.997 100.0 6.9
2.430-2.280 0.0970 0.1050 0.995 100.0 6.7
2.280-2.150 0.1250 0.1360 0.992 100.0 6.3
2.150-2.040 0.1640 0.1780 0.987 99.9 6.7
2.040-1.940 0.2270 0.2460 0.978 99.9 6.8
1.940-1.860 0.3060 0.3310 0.961 100.0 6.9
1.860-1.790 0.4210 0.4570 0.928 100.0 6.6
1.790-1.720 0.5710 0.6230 0.879 100.0 6.3
1.720-1.660 0.8170 0.8880 0.775 100.0 6.6
1.660-1.610 1.0170 1.1030 0.689 100.0 6.7
1.610-1.560 1.2930 1.4010 0.591 100.0 6.8
1.560-1.520 1.6560 1.8000 0.468 100.0 6.6
1.520-1.480 2.3270 2.5400 0.319 99.9 6.3
1.480-1.440 2.7300 2.9660 0.254 100.0 6.6