Data quality metrics extracted from 7ack.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": "7d305b8d090f9f3a7bca1618037529b3",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 71.305,
    "b": 163.451,
    "c": 73.190,
    "alpha": 90.00,
    "beta": 106.18,
    "gamma": 90.00
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [47.162,1.800],
    "number_observations": 563689,
    "number_observations_unique": 146615,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.095
      },
      {
        "type": "R(meas)",
        "value": 0.111
      },
      {
        "type": "I/SigI",
        "value": 9.700
      },
      {
        "type": "Completeness",
        "value": 98.500
      },
      {
        "type": "Redundancy",
        "value": 3.845
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.910,1.800],
      "number_observations": 90881,
      "number_observations_unique": 23428,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.125
        },
        {
          "type": "R(meas)",
          "value": 2.462
        },
        {
          "type": "I/SigI",
          "value": 0.600
        },
        {
          "type": "Completeness",
          "value": 97.700
        },
        {
          "type": "Redundancy",
          "value": 3.879
        },
        {
          "type": "CC(1/2)",
          "value": 0.314
        }
      ]
    },
    {
      "resolution_limits": [2.040,1.910],
      "number_observations": 82308,
      "number_observations_unique": 22147,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.961
        },
        {
          "type": "R(meas)",
          "value": 1.122
        },
        {
          "type": "I/SigI",
          "value": 1.320
        },
        {
          "type": "Completeness",
          "value": 98.000
        },
        {
          "type": "Redundancy",
          "value": 3.716
        },
        {
          "type": "CC(1/2)",
          "value": 0.601
        }
      ]
    },
    {
      "resolution_limits": [2.200,2.040],
      "number_observations": 82577,
      "number_observations_unique": 20765,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.550
        },
        {
          "type": "R(meas)",
          "value": 0.635
        },
        {
          "type": "I/SigI",
          "value": 2.490
        },
        {
          "type": "Completeness",
          "value": 99.100
        },
        {
          "type": "Redundancy",
          "value": 3.977
        },
        {
          "type": "CC(1/2)",
          "value": 0.832
        }
      ]
    },
    {
      "resolution_limits": [2.410,2.200],
      "number_observations": 73610,
      "number_observations_unique": 19165,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.312
        },
        {
          "type": "R(meas)",
          "value": 0.363
        },
        {
          "type": "I/SigI",
          "value": 4.250
        },
        {
          "type": "Completeness",
          "value": 98.800
        },
        {
          "type": "Redundancy",
          "value": 3.841
        },
        {
          "type": "CC(1/2)",
          "value": 0.932
        }
      ]
    },
    {
      "resolution_limits": [2.700,2.410],
      "number_observations": 66462,
      "number_observations_unique": 17267,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.178
        },
        {
          "type": "R(meas)",
          "value": 0.206
        },
        {
          "type": "I/SigI",
          "value": 7.200
        },
        {
          "type": "Completeness",
          "value": 98.800
        },
        {
          "type": "Redundancy",
          "value": 3.849
        },
        {
          "type": "CC(1/2)",
          "value": 0.975
        }
      ]
    },
    {
      "resolution_limits": [3.110,2.700],
      "number_observations": 59374,
      "number_observations_unique": 15289,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.096
        },
        {
          "type": "R(meas)",
          "value": 0.112
        },
        {
          "type": "I/SigI",
          "value": 12.740
        },
        {
          "type": "Completeness",
          "value": 98.900
        },
        {
          "type": "Redundancy",
          "value": 3.883
        },
        {
          "type": "CC(1/2)",
          "value": 0.993
        }
      ]
    },
    {
      "resolution_limits": [3.810,3.110],
      "number_observations": 49554,
      "number_observations_unique": 12949,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.045
        },
        {
          "type": "R(meas)",
          "value": 0.052
        },
        {
          "type": "I/SigI",
          "value": 25.020
        },
        {
          "type": "Completeness",
          "value": 98.900
        },
        {
          "type": "Redundancy",
          "value": 3.827
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [5.360,3.810],
      "number_observations": 37347,
      "number_observations_unique": 9943,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.030
        },
        {
          "type": "R(meas)",
          "value": 0.035
        },
        {
          "type": "I/SigI",
          "value": 36.740
        },
        {
          "type": "Completeness",
          "value": 98.100
        },
        {
          "type": "Redundancy",
          "value": 3.756
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [47.162,5.360],
      "number_observations": 21576,
      "number_observations_unique": 5662,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.024
        },
        {
          "type": "R(meas)",
          "value": 0.027
        },
        {
          "type": "I/SigI",
          "value": 41.920
        },
        {
          "type": "Completeness",
          "value": 98.800
        },
        {
          "type": "Redundancy",
          "value": 3.811
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 47.162 47.162 2.040
High resolution limit [Å] 1.800 5.360 1.910
R(merge) 0.0950 0.0240 0.9610
R(meas) 0.1110 0.0270 1.1220
CC(1/2) 0.998 0.999 0.601
Completeness [%] 98.5 98.8 98.0
Multiplicity 3.8 3.8 3.7


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

Resolution [Å] R(merge) R(meas) CC(1/2) Completeness [%] Multiplicity
47.162-5.360 0.0240 0.0270 0.999 98.8 3.8
5.360-3.810 0.0300 0.0350 0.999 98.1 3.8
3.810-3.110 0.0450 0.0520 0.998 98.9 3.8
3.110-2.700 0.0960 0.1120 0.993 98.9 3.9
2.700-2.410 0.1780 0.2060 0.975 98.8 3.8
2.410-2.200 0.3120 0.3630 0.932 98.8 3.8
2.200-2.040 0.5500 0.6350 0.832 99.1 4.0
2.040-1.910 0.9610 1.1220 0.601 98.0 3.7
1.910-1.800 2.1250 2.4620 0.314 97.7 3.9