Data quality metrics extracted from 8okp.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": "2c9cd47d75d89690d549b363d697ba38",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 41.83,
    "b": 41.20,
    "c": 72.25,
    "alpha": 90.00,
    "beta": 103.77,
    "gamma": 90.00
  },
  "wavelengths": [1.45187],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.0,1.25],
    "number_observations_unique": 62780,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.034
      },
      {
        "type": "R(meas)",
        "value": 0.038
      },
      {
        "type": "I/SigI",
        "value": 17.37
      },
      {
        "type": "Completeness",
        "value": 94.9
      },
      {
        "type": "Redundancy",
        "value": 3.3
      },
      {
        "type": "CC(1/2)",
        "value": 1.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.28,1.25],
      "number_observations_unique": 2125,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.38299999999999995
        },
        {
          "type": "R(meas)",
          "value": 0.522
        },
        {
          "type": "CC(1/2)",
          "value": 0.701
        }
      ]
    },
    {
      "resolution_limits": [1.32,1.28],
      "number_observations_unique": 4532,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.365
        },
        {
          "type": "R(meas)",
          "value": 0.47600000000000003
        },
        {
          "type": "CC(1/2)",
          "value": 0.7859999999999999
        }
      ]
    },
    {
      "resolution_limits": [1.36,1.32],
      "number_observations_unique": 4477,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.34
        },
        {
          "type": "R(meas)",
          "value": 0.436
        },
        {
          "type": "CC(1/2)",
          "value": 0.8340000000000001
        }
      ]
    },
    {
      "resolution_limits": [1.4,1.36],
      "number_observations_unique": 4436,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.28
        },
        {
          "type": "R(meas)",
          "value": 0.35600000000000004
        },
        {
          "type": "CC(1/2)",
          "value": 0.883
        }
      ]
    },
    {
      "resolution_limits": [1.44,1.40],
      "number_observations_unique": 4320,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.245
        },
        {
          "type": "R(meas)",
          "value": 0.308
        },
        {
          "type": "CC(1/2)",
          "value": 0.9129999999999999
        }
      ]
    },
    {
      "resolution_limits": [1.5,1.44],
      "number_observations_unique": 4178,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.196
        },
        {
          "type": "R(meas)",
          "value": 0.243
        },
        {
          "type": "CC(1/2)",
          "value": 0.9490000000000001
        }
      ]
    },
    {
      "resolution_limits": [1.55,1.50],
      "number_observations_unique": 4045,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.168
        },
        {
          "type": "R(meas)",
          "value": 0.20600000000000002
        },
        {
          "type": "CC(1/2)",
          "value": 0.9640000000000001
        }
      ]
    },
    {
      "resolution_limits": [1.62,1.55],
      "number_observations_unique": 3886,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.132
        },
        {
          "type": "R(meas)",
          "value": 0.161
        },
        {
          "type": "CC(1/2)",
          "value": 0.976
        }
      ]
    },
    {
      "resolution_limits": [1.69,1.62],
      "number_observations_unique": 3743,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.109
        },
        {
          "type": "R(meas)",
          "value": 0.133
        },
        {
          "type": "CC(1/2)",
          "value": 0.985
        }
      ]
    },
    {
      "resolution_limits": [1.77,1.69],
      "number_observations_unique": 3602,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.086
        },
        {
          "type": "R(meas)",
          "value": 0.105
        },
        {
          "type": "CC(1/2)",
          "value": 0.99
        }
      ]
    },
    {
      "resolution_limits": [1.87,1.77],
      "number_observations_unique": 3385,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.07
        },
        {
          "type": "R(meas)",
          "value": 0.086
        },
        {
          "type": "CC(1/2)",
          "value": 0.992
        }
      ]
    },
    {
      "resolution_limits": [1.98,1.87],
      "number_observations_unique": 3146,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.051
        },
        {
          "type": "R(meas)",
          "value": 0.064
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [2.11,1.98],
      "number_observations_unique": 3001,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.043
        },
        {
          "type": "R(meas)",
          "value": 0.051
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [2.28,2.11],
      "number_observations_unique": 2845,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.037000000000000005
        },
        {
          "type": "R(meas)",
          "value": 0.043
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [2.5,2.28],
      "number_observations_unique": 2614,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.035
        },
        {
          "type": "R(meas)",
          "value": 0.04
        },
        {
          "type": "CC(1/2)",
          "value": 0.9990000000000001
        }
      ]
    },
    {
      "resolution_limits": [2.8,2.50],
      "number_observations_unique": 2385,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.031
        },
        {
          "type": "R(meas)",
          "value": 0.036000000000000004
        },
        {
          "type": "CC(1/2)",
          "value": 0.9990000000000001
        }
      ]
    },
    {
      "resolution_limits": [3.23,2.80],
      "number_observations_unique": 2087,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.028999999999999998
        },
        {
          "type": "R(meas)",
          "value": 0.032
        },
        {
          "type": "CC(1/2)",
          "value": 0.9990000000000001
        }
      ]
    },
    {
      "resolution_limits": [3.96,3.23],
      "number_observations_unique": 1783,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.025
        },
        {
          "type": "R(meas)",
          "value": 0.027000000000000003
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    },
    {
      "resolution_limits": [5.6,3.96],
      "number_observations_unique": 1394,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.021
        },
        {
          "type": "R(meas)",
          "value": 0.022000000000000002
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    },
    {
      "resolution_limits": [50.0,5.60],
      "number_observations_unique": 796,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.02
        },
        {
          "type": "R(meas)",
          "value": 0.022000000000000002
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 50.000 50.000 1.320
High resolution limit [Å] 1.250 5.600 1.280
R(merge) 0.0340 0.0200 0.3650
R(meas) 0.0380 0.0220 0.4760
CC(1/2) 1.000 1.000 0.786
Completeness [%] 94.9 - -
Multiplicity 3.3 - -


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

Resolution [Å] R(merge) R(meas) CC(1/2)
50.000-5.600 0.0200 0.0220 1.000
5.600-3.960 0.0210 0.0220 1.000
3.960-3.230 0.0250 0.0270 1.000
3.230-2.800 0.0290 0.0320 0.999
2.800-2.500 0.0310 0.0360 0.999
2.500-2.280 0.0350 0.0400 0.999
2.280-2.110 0.0370 0.0430 0.998
2.110-1.980 0.0430 0.0510 0.997
1.980-1.870 0.0510 0.0640 0.995
1.870-1.770 0.0700 0.0860 0.992
1.770-1.690 0.0860 0.1050 0.990
1.690-1.620 0.1090 0.1330 0.985
1.620-1.550 0.1320 0.1610 0.976
1.550-1.500 0.1680 0.2060 0.964
1.500-1.440 0.1960 0.2430 0.949
1.440-1.400 0.2450 0.3080 0.913
1.400-1.360 0.2800 0.3560 0.883
1.360-1.320 0.3400 0.4360 0.834
1.320-1.280 0.3650 0.4760 0.786
1.280-1.250 0.3830 0.5220 0.701