Data quality metrics extracted from 2g1l.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": "0274cddd7fee019b4ff6eec7fd42efc1",
  "space_group_name": "P 61 2 2",
  "unit_cell": {
    "a": 107.620,
    "b": 107.620,
    "c": 82.995,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [30.000,2.600],
    "number_observations_unique": 9139,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.121
      },
      {
        "type": "I/SigI",
        "value": 8.300
      },
      {
        "type": "Completeness",
        "value": 99.800
      },
      {
        "type": "Redundancy",
        "value": 20.900
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.69,2.60],
      "number_observations_unique": 877,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.94
        },
        {
          "type": "Redundancy",
          "value": 21.30
        }
      ]
    },
    {
      "resolution_limits": [2.80,2.69],
      "number_observations_unique": 881,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.72
        },
        {
          "type": "Redundancy",
          "value": 21.40
        }
      ]
    },
    {
      "resolution_limits": [2.93,2.80],
      "number_observations_unique": 884,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.554
        },
        {
          "type": "Redundancy",
          "value": 21.30
        }
      ]
    },
    {
      "resolution_limits": [3.08,2.93],
      "number_observations_unique": 909,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.389
        },
        {
          "type": "Redundancy",
          "value": 21.30
        }
      ]
    },
    {
      "resolution_limits": [3.28,3.08],
      "number_observations_unique": 882,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.249
        },
        {
          "type": "Redundancy",
          "value": 21.20
        }
      ]
    },
    {
      "resolution_limits": [3.53,3.28],
      "number_observations_unique": 906,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.15
        },
        {
          "type": "Redundancy",
          "value": 21.20
        }
      ]
    },
    {
      "resolution_limits": [3.88,3.53],
      "number_observations_unique": 918,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.115
        },
        {
          "type": "Redundancy",
          "value": 21.00
        }
      ]
    },
    {
      "resolution_limits": [4.44,3.88],
      "number_observations_unique": 922,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.073
        },
        {
          "type": "Redundancy",
          "value": 20.90
        }
      ]
    },
    {
      "resolution_limits": [5.59,4.44],
      "number_observations_unique": 936,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.053
        },
        {
          "type": "Redundancy",
          "value": 20.60
        }
      ]
    },
    {
      "resolution_limits": [30.00,5.59],
      "number_observations_unique": 1024,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.039
        },
        {
          "type": "Redundancy",
          "value": 19.00
        }
      ]
    }
  ]

}
  

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


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