Data quality metrics extracted from 6t0j.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": "1f6efa8ba7d115fe7c10bc1aafeeb2b4",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 51.54,
    "b": 75.11,
    "c": 56.59,
    "alpha": 90.00,
    "beta": 106.84,
    "gamma": 90.00
  },
  "wavelengths": [0.97200],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [30,1.1],
    "number_observations_unique": 162381,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.193
      },
      {
        "type": "I/SigI",
        "value": 5.5
      },
      {
        "type": "Completeness",
        "value": 97.4
      },
      {
        "type": "Redundancy",
        "value": 6.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [30,4.92],
      "number_observations_unique": 1926,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.058
        },
        {
          "type": "I/SigI",
          "value": 28.9
        },
        {
          "type": "Completeness",
          "value": 99.1
        },
        {
          "type": "Redundancy",
          "value": 7.0
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [4.92,3.48],
      "number_observations_unique": 3340,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.061
        },
        {
          "type": "I/SigI",
          "value": 27.2
        },
        {
          "type": "Completeness",
          "value": 96.5
        },
        {
          "type": "Redundancy",
          "value": 6.2
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [3.48,2.84],
      "number_observations_unique": 4410,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.077
        },
        {
          "type": "I/SigI",
          "value": 23.8
        },
        {
          "type": "Completeness",
          "value": 99.1
        },
        {
          "type": "Redundancy",
          "value": 6.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [2.84,2.46],
      "number_observations_unique": 5210,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.104
        },
        {
          "type": "I/SigI",
          "value": 19.8
        },
        {
          "type": "Completeness",
          "value": 99.2
        },
        {
          "type": "Redundancy",
          "value": 7.1
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [2.46,2.2],
      "number_observations_unique": 5857,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.122
        },
        {
          "type": "I/SigI",
          "value": 16.7
        },
        {
          "type": "Completeness",
          "value": 97.9
        },
        {
          "type": "Redundancy",
          "value": 6.8
        },
        {
          "type": "CC(1/2)",
          "value": 0.992
        }
      ]
    },
    {
      "resolution_limits": [2.2,2.01],
      "number_observations_unique": 6414,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.147
        },
        {
          "type": "I/SigI",
          "value": 13.3
        },
        {
          "type": "Completeness",
          "value": 97.6
        },
        {
          "type": "Redundancy",
          "value": 6.5
        },
        {
          "type": "CC(1/2)",
          "value": 0.989
        }
      ]
    },
    {
      "resolution_limits": [2.01,1.86],
      "number_observations_unique": 7098,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.186
        },
        {
          "type": "I/SigI",
          "value": 10.6
        },
        {
          "type": "Completeness",
          "value": 99.4
        },
        {
          "type": "Redundancy",
          "value": 6.8
        },
        {
          "type": "CC(1/2)",
          "value": 0.985
        }
      ]
    },
    {
      "resolution_limits": [1.86,1.74],
      "number_observations_unique": 7584,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.247
        },
        {
          "type": "I/SigI",
          "value": 7.9
        },
        {
          "type": "Completeness",
          "value": 99
        },
        {
          "type": "Redundancy",
          "value": 6.9
        },
        {
          "type": "CC(1/2)",
          "value": 0.973
        }
      ]
    },
    {
      "resolution_limits": [1.74,1.64],
      "number_observations_unique": 8088,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.334
        },
        {
          "type": "I/SigI",
          "value": 5.8
        },
        {
          "type": "Completeness",
          "value": 98.9
        },
        {
          "type": "Redundancy",
          "value": 7.0
        },
        {
          "type": "CC(1/2)",
          "value": 0.956
        }
      ]
    },
    {
      "resolution_limits": [1.64,1.56],
      "number_observations_unique": 8284,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.415
        },
        {
          "type": "I/SigI",
          "value": 4.4
        },
        {
          "type": "Completeness",
          "value": 96.2
        },
        {
          "type": "Redundancy",
          "value": 6.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.930
        }
      ]
    },
    {
      "resolution_limits": [1.56,1.48],
      "number_observations_unique": 8894,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.533
        },
        {
          "type": "I/SigI",
          "value": 3.5
        },
        {
          "type": "Completeness",
          "value": 98.3
        },
        {
          "type": "Redundancy",
          "value": 6.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.888
        }
      ]
    },
    {
      "resolution_limits": [1.48,1.42],
      "number_observations_unique": 9351,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.706
        },
        {
          "type": "I/SigI",
          "value": 2.6
        },
        {
          "type": "Completeness",
          "value": 98.9
        },
        {
          "type": "Redundancy",
          "value": 6.8
        },
        {
          "type": "CC(1/2)",
          "value": 0.804
        }
      ]
    },
    {
      "resolution_limits": [1.42,1.36],
      "number_observations_unique": 9750,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.870
        },
        {
          "type": "I/SigI",
          "value": 2.0
        },
        {
          "type": "Completeness",
          "value": 98.6
        },
        {
          "type": "Redundancy",
          "value": 6.9
        },
        {
          "type": "CC(1/2)",
          "value": 0.735
        }
      ]
    },
    {
      "resolution_limits": [1.36,1.32],
      "number_observations_unique": 9959,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.029
        },
        {
          "type": "I/SigI",
          "value": 1.6
        },
        {
          "type": "Completeness",
          "value": 97.5
        },
        {
          "type": "Redundancy",
          "value": 6.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.683
        }
      ]
    },
    {
      "resolution_limits": [1.32,1.27],
      "number_observations_unique": 10353,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.254
        },
        {
          "type": "I/SigI",
          "value": 1.3
        },
        {
          "type": "Completeness",
          "value": 97.2
        },
        {
          "type": "Redundancy",
          "value": 6.4
        },
        {
          "type": "CC(1/2)",
          "value": 0.559
        }
      ]
    },
    {
      "resolution_limits": [1.27,1.23],
      "number_observations_unique": 10724,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.453
        },
        {
          "type": "I/SigI",
          "value": 1.1
        },
        {
          "type": "Completeness",
          "value": 97.9
        },
        {
          "type": "Redundancy",
          "value": 6.6
        },
        {
          "type": "CC(1/2)",
          "value": 0.475
        }
      ]
    },
    {
      "resolution_limits": [1.23,1.19],
      "number_observations_unique": 11091,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.686
        },
        {
          "type": "I/SigI",
          "value": 0.9
        },
        {
          "type": "Completeness",
          "value": 97.9
        },
        {
          "type": "Redundancy",
          "value": 6.4
        },
        {
          "type": "CC(1/2)",
          "value": 0.390
        }
      ]
    },
    {
      "resolution_limits": [1.19,1.16],
      "number_observations_unique": 11335,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.890
        },
        {
          "type": "I/SigI",
          "value": 0.7
        },
        {
          "type": "Completeness",
          "value": 97.2
        },
        {
          "type": "Redundancy",
          "value": 6.2
        },
        {
          "type": "CC(1/2)",
          "value": 0.322
        }
      ]
    },
    {
      "resolution_limits": [1.16,1.13],
      "number_observations_unique": 11580,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 2.246
        },
        {
          "type": "I/SigI",
          "value": 0.6
        },
        {
          "type": "Completeness",
          "value": 96.4
        },
        {
          "type": "Redundancy",
          "value": 5.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.252
        }
      ]
    },
    {
      "resolution_limits": [1.13,1.1],
      "number_observations_unique": 11133,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 2.751
        },
        {
          "type": "I/SigI",
          "value": 0.4
        },
        {
          "type": "Completeness",
          "value": 90.9
        },
        {
          "type": "Redundancy",
          "value": 5.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.168
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 30.000 4.920 1.130
High resolution limit [Å] 1.100 3.480 1.100
R(meas) 0.1930 0.0610 2.7510
CC(1/2) 0.997 0.996 0.168
Completeness [%] 97.4 96.5 90.9
Multiplicity 6.5 6.2 5.7


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

Resolution [Å] R(meas) CC(1/2) Completeness [%] Multiplicity
30.000-4.920 0.0580 0.997 99.1 7.0
4.920-3.480 0.0610 0.996 96.5 6.2
3.480-2.840 0.0770 0.996 99.1 6.7
2.840-2.460 0.1040 0.995 99.2 7.1
2.460-2.200 0.1220 0.992 97.9 6.8
2.200-2.010 0.1470 0.989 97.6 6.5
2.010-1.860 0.1860 0.985 99.4 6.8
1.860-1.740 0.2470 0.973 99.0 6.9
1.740-1.640 0.3340 0.956 98.9 7.0
1.640-1.560 0.4150 0.930 96.2 6.3
1.560-1.480 0.5330 0.888 98.3 6.7
1.480-1.420 0.7060 0.804 98.9 6.8
1.420-1.360 0.8700 0.735 98.6 6.9
1.360-1.320 1.0290 0.683 97.5 6.7
1.320-1.270 1.2540 0.559 97.2 6.4
1.270-1.230 1.4530 0.475 97.9 6.6
1.230-1.190 1.6860 0.390 97.9 6.4
1.190-1.160 1.8900 0.322 97.2 6.2
1.160-1.130 2.2460 0.252 96.4 5.7
1.130-1.100 2.7510 0.168 90.9 5.7