Data quality metrics extracted from 4wro.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": "3de9169e2e682f2e86a15f7594f37c66",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 209.4,
    "b": 447.7,
    "c": 619.4,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [200,3.050],
    "number_observations": 69639588,
    "number_observations_unique": 1092032,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.325
      },
      {
        "type": "R(meas)",
        "value": 0.327
      },
      {
        "type": "I/SigI",
        "value": 14.160
      },
      {
        "type": "Completeness",
        "value": 99.900
      },
      {
        "type": "Redundancy",
        "value": 63.8
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.150,3.050],
      "number_observations": 3625135,
      "number_observations_unique": 100022,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 4.566
        },
        {
          "type": "R(meas)",
          "value": 4.629
        },
        {
          "type": "I/SigI",
          "value": 0.970
        },
        {
          "type": "Completeness",
          "value": 99.900
        }
      ]
    },
    {
      "resolution_limits": [3.250,3.150],
      "number_observations": 4385501,
      "number_observations_unique": 88242,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.419
        },
        {
          "type": "R(meas)",
          "value": 3.453
        },
        {
          "type": "I/SigI",
          "value": 1.600
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [3.300,3.250],
      "number_observations": 2049817,
      "number_observations_unique": 40203,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.789
        },
        {
          "type": "R(meas)",
          "value": 2.817
        },
        {
          "type": "I/SigI",
          "value": 2.070
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [3.400,3.300],
      "number_observations": 4193396,
      "number_observations_unique": 73484,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.439
        },
        {
          "type": "R(meas)",
          "value": 2.460
        },
        {
          "type": "I/SigI",
          "value": 2.590
        },
        {
          "type": "Completeness",
          "value": 99.900
        }
      ]
    },
    {
      "resolution_limits": [3.500,3.400],
      "number_observations": 3885117,
      "number_observations_unique": 65398,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.040
        },
        {
          "type": "R(meas)",
          "value": 2.058
        },
        {
          "type": "I/SigI",
          "value": 3.210
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [4.000,3.500],
      "number_observations": 15264783,
      "number_observations_unique": 237688,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.084
        },
        {
          "type": "R(meas)",
          "value": 1.091
        },
        {
          "type": "I/SigI",
          "value": 6.170
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [5.000,4.000],
      "number_observations": 16951609,
      "number_observations_unique": 236204,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.464
        },
        {
          "type": "R(meas)",
          "value": 0.468
        },
        {
          "type": "I/SigI",
          "value": 15.350
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [10.000,5.000],
      "number_observations": 16916164,
      "number_observations_unique": 218702,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.210
        },
        {
          "type": "R(meas)",
          "value": 0.212
        },
        {
          "type": "I/SigI",
          "value": 34.460
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [15.000,10.000],
      "number_observations": 1679464,
      "number_observations_unique": 22492,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.111
        },
        {
          "type": "R(meas)",
          "value": 0.111
        },
        {
          "type": "I/SigI",
          "value": 63.110
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [50.000,15.000],
      "number_observations": 684417,
      "number_observations_unique": 9425,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.082
        },
        {
          "type": "R(meas)",
          "value": 0.082
        },
        {
          "type": "I/SigI",
          "value": 72.160
        },
        {
          "type": "Completeness",
          "value": 99.000
        }
      ]
    },
    {
      "resolution_limits": [70.000,50.000],
      "number_observations": 4041,
      "number_observations_unique": 146,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.101
        },
        {
          "type": "R(meas)",
          "value": 0.102
        },
        {
          "type": "I/SigI",
          "value": 50.030
        },
        {
          "type": "Completeness",
          "value": 74.900
        }
      ]
    },
    {
      "resolution_limits": [100.000,70.000],
      "number_observations": 108,
      "number_observations_unique": 15,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.028
        },
        {
          "type": "R(meas)",
          "value": 0.030
        },
        {
          "type": "I/SigI",
          "value": 29.900
        },
        {
          "type": "Completeness",
          "value": 20.300
        }
      ]
    },
    {
      "resolution_limits": [200,100.000],
      "number_observations": 36,
      "number_observations_unique": 11,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.029
        },
        {
          "type": "R(meas)",
          "value": 0.034
        },
        {
          "type": "I/SigI",
          "value": 20.250
        },
        {
          "type": "Completeness",
          "value": 23.900
        }
      ]
    }
  ]

}
  

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


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