Data quality metrics extracted from 2f6r.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": "cbf1cf9fd4e313e050bbd5ae920bd179",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 101.04,
    "b": 32.37,
    "c": 95.20,
    "alpha": 90.00,
    "beta": 110.24,
    "gamma": 90.00
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [28.030,1.70],
    "number_observations_unique": 32283,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.053
      },
      {
        "type": "I/SigI",
        "value": 12.690
      },
      {
        "type": "Completeness",
        "value": 93.200
      },
      {
        "type": "Redundancy",
        "value": 2.55
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.76,1.70],
      "number_observations": 9408,
      "number_observations_unique": 4910,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 1.790
        },
        {
          "type": "Completeness",
          "value": 99.6
        }
      ]
    },
    {
      "resolution_limits": [1.83,1.76],
      "number_observations": 10152,
      "number_observations_unique": 5270,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 2.240
        }
      ]
    },
    {
      "resolution_limits": [1.91,1.83],
      "number_observations": 10194,
      "number_observations_unique": 5275,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 2.970
        }
      ]
    },
    {
      "resolution_limits": [2.02,1.91],
      "number_observations": 12004,
      "number_observations_unique": 6246,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 4.440
        }
      ]
    },
    {
      "resolution_limits": [2.14,2.02],
      "number_observations": 10730,
      "number_observations_unique": 5579,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 6.340
        }
      ]
    },
    {
      "resolution_limits": [2.31,2.14],
      "number_observations": 12038,
      "number_observations_unique": 6247,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 9.270
        }
      ]
    },
    {
      "resolution_limits": [2.54,2.31],
      "number_observations": 16501,
      "number_observations_unique": 6003,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 13.110
        }
      ]
    },
    {
      "resolution_limits": [2.90,2.54],
      "number_observations": 22851,
      "number_observations_unique": 6078,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 17.910
        }
      ]
    },
    {
      "resolution_limits": [3.66,2.90],
      "number_observations": 24287,
      "number_observations_unique": 6269,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 25.940
        }
      ]
    },
    {
      "resolution_limits": [28.030,3.66],
      "number_observations": 23740,
      "number_observations_unique": 6213,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.661
        },
        {
          "type": "I/SigI",
          "value": 36.950
        }
      ]
    }
  ]

}
  

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


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