Data quality metrics extracted from 3hht.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": "e5723370611a4d0aecd8ca4a3a48008e",
  "space_group_name": "P 41 21 2",
  "unit_cell": {
    "a": 105.832,
    "b": 105.832,
    "c": 83.723,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97900],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [26.990,1.160],
    "number_observations_unique": 162627,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.047
      },
      {
        "type": "Completeness",
        "value": 99.600
      },
      {
        "type": "Redundancy",
        "value": 5.580
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.20,1.16],
      "number_observations": 88510,
      "number_observations_unique": 16139,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.300
        },
        {
          "type": "I/SigI",
          "value": 4.1
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.41
        }
      ]
    },
    {
      "resolution_limits": [1.25,1.20],
      "number_observations": 89572,
      "number_observations_unique": 16183,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.258
        },
        {
          "type": "I/SigI",
          "value": 4.4
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.50
        }
      ]
    },
    {
      "resolution_limits": [1.31,1.25],
      "number_observations": 90078,
      "number_observations_unique": 16158,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.211
        },
        {
          "type": "I/SigI",
          "value": 5.3
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.54
        }
      ]
    },
    {
      "resolution_limits": [1.38,1.31],
      "number_observations": 90970,
      "number_observations_unique": 16177,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.167
        },
        {
          "type": "I/SigI",
          "value": 6.4
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.59
        }
      ]
    },
    {
      "resolution_limits": [1.46,1.38],
      "number_observations": 91746,
      "number_observations_unique": 16182,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.129
        },
        {
          "type": "I/SigI",
          "value": 8.0
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.63
        }
      ]
    },
    {
      "resolution_limits": [1.57,1.46],
      "number_observations": 92876,
      "number_observations_unique": 16274,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.092
        },
        {
          "type": "I/SigI",
          "value": 10.7
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.66
        }
      ]
    },
    {
      "resolution_limits": [1.73,1.57],
      "number_observations": 93072,
      "number_observations_unique": 16283,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.075
        },
        {
          "type": "I/SigI",
          "value": 13.2
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.67
        }
      ]
    },
    {
      "resolution_limits": [1.98,1.73],
      "number_observations": 93674,
      "number_observations_unique": 16385,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.073
        },
        {
          "type": "I/SigI",
          "value": 13.4
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.68
        }
      ]
    },
    {
      "resolution_limits": [2.50,1.98],
      "number_observations": 94650,
      "number_observations_unique": 16483,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.045
        },
        {
          "type": "I/SigI",
          "value": 21.5
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.71
        }
      ]
    },
    {
      "resolution_limits": [26.99,2.50],
      "number_observations": 89532,
      "number_observations_unique": 16363,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.025
        },
        {
          "type": "I/SigI",
          "value": 42.0
        },
        {
          "type": "Completeness",
          "value": 96.20
        },
        {
          "type": "Redundancy",
          "value": 5.43
        }
      ]
    }
  ]

}
  

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


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