Data quality metrics extracted from 3l0s.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": "ebb5fef9e321880db05dd25c2b6de49e",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 131.43,
    "b": 39.49,
    "c": 94.20,
    "alpha": 90.00,
    "beta": 109.31,
    "gamma": 90.00
  },
  "wavelengths": [1.60640],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [88.891,2.000],
    "number_observations": 105651,
    "number_observations_unique": 30472,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.076
      },
      {
        "type": "R(meas)",
        "value": 0.105
      },
      {
        "type": "R(pim)",
        "value": 0.056
      },
      {
        "type": "I/SigI",
        "value": 13.300
      },
      {
        "type": "Completeness",
        "value": 97.200
      },
      {
        "type": "Redundancy",
        "value": 3.500
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.11,2.00],
      "number_observations": 14814,
      "number_observations_unique": 4280,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.426
        },
        {
          "type": "R(meas)",
          "value": 0.61
        },
        {
          "type": "R(pim)",
          "value": 0.32
        },
        {
          "type": "I/SigI",
          "value": 1.7
        },
        {
          "type": "Completeness",
          "value": 94.60
        },
        {
          "type": "Redundancy",
          "value": 3.50
        }
      ]
    },
    {
      "resolution_limits": [2.24,2.11],
      "number_observations": 14265,
      "number_observations_unique": 4117,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.273
        },
        {
          "type": "R(meas)",
          "value": 0.39
        },
        {
          "type": "R(pim)",
          "value": 0.20
        },
        {
          "type": "I/SigI",
          "value": 2.6
        },
        {
          "type": "Completeness",
          "value": 95.90
        },
        {
          "type": "Redundancy",
          "value": 3.50
        }
      ]
    },
    {
      "resolution_limits": [2.39,2.24],
      "number_observations": 13727,
      "number_observations_unique": 3912,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.192
        },
        {
          "type": "R(meas)",
          "value": 0.27
        },
        {
          "type": "R(pim)",
          "value": 0.14
        },
        {
          "type": "I/SigI",
          "value": 2.4
        },
        {
          "type": "Completeness",
          "value": 96.60
        },
        {
          "type": "Redundancy",
          "value": 3.50
        }
      ]
    },
    {
      "resolution_limits": [2.58,2.39],
      "number_observations": 12850,
      "number_observations_unique": 3647,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.138
        },
        {
          "type": "R(meas)",
          "value": 0.19
        },
        {
          "type": "R(pim)",
          "value": 0.10
        },
        {
          "type": "I/SigI",
          "value": 5.2
        },
        {
          "type": "Completeness",
          "value": 97.00
        },
        {
          "type": "Redundancy",
          "value": 3.50
        }
      ]
    },
    {
      "resolution_limits": [2.83,2.58],
      "number_observations": 12025,
      "number_observations_unique": 3402,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.099
        },
        {
          "type": "R(meas)",
          "value": 0.14
        },
        {
          "type": "R(pim)",
          "value": 0.07
        },
        {
          "type": "I/SigI",
          "value": 7.3
        },
        {
          "type": "Completeness",
          "value": 97.00
        },
        {
          "type": "Redundancy",
          "value": 3.50
        }
      ]
    },
    {
      "resolution_limits": [3.16,2.83],
      "number_observations": 10743,
      "number_observations_unique": 3089,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.068
        },
        {
          "type": "R(meas)",
          "value": 0.10
        },
        {
          "type": "R(pim)",
          "value": 0.05
        },
        {
          "type": "I/SigI",
          "value": 9.9
        },
        {
          "type": "Completeness",
          "value": 98.90
        },
        {
          "type": "Redundancy",
          "value": 3.50
        }
      ]
    },
    {
      "resolution_limits": [3.65,3.16],
      "number_observations": 9507,
      "number_observations_unique": 2774,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.053
        },
        {
          "type": "R(meas)",
          "value": 0.08
        },
        {
          "type": "R(pim)",
          "value": 0.04
        },
        {
          "type": "I/SigI",
          "value": 11.3
        },
        {
          "type": "Completeness",
          "value": 98.70
        },
        {
          "type": "Redundancy",
          "value": 3.40
        }
      ]
    },
    {
      "resolution_limits": [4.47,3.65],
      "number_observations": 7608,
      "number_observations_unique": 2346,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.039
        },
        {
          "type": "R(meas)",
          "value": 0.05
        },
        {
          "type": "R(pim)",
          "value": 0.03
        },
        {
          "type": "I/SigI",
          "value": 12.2
        },
        {
          "type": "Completeness",
          "value": 99.20
        },
        {
          "type": "Redundancy",
          "value": 3.20
        }
      ]
    },
    {
      "resolution_limits": [6.32,4.47],
      "number_observations": 6510,
      "number_observations_unique": 1843,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.031
        },
        {
          "type": "R(meas)",
          "value": 0.05
        },
        {
          "type": "R(pim)",
          "value": 0.02
        },
        {
          "type": "I/SigI",
          "value": 17.7
        },
        {
          "type": "Completeness",
          "value": 99.40
        },
        {
          "type": "Redundancy",
          "value": 3.50
        }
      ]
    },
    {
      "resolution_limits": [44.46,6.32],
      "number_observations": 3602,
      "number_observations_unique": 1062,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.032
        },
        {
          "type": "R(meas)",
          "value": 0.05
        },
        {
          "type": "R(pim)",
          "value": 0.03
        },
        {
          "type": "I/SigI",
          "value": 14.4
        },
        {
          "type": "Completeness",
          "value": 99.70
        },
        {
          "type": "Redundancy",
          "value": 3.40
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 88.891 44.460 2.240
High resolution limit [Å] 2.000 6.320 2.110
R(merge) 0.0760 0.0320 0.2730
R(meas) 0.1050 0.0500 0.3900
R(pim) 0.0560 0.0300 0.2000
Completeness [%] 97.2 99.7 95.9
Multiplicity 3.5 3.4 3.5


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

Resolution [Å] R(merge) R(meas) R(pim) Completeness [%] Multiplicity
44.460-6.320 0.0320 0.0500 0.0300 99.7 3.4
6.320-4.470 0.0310 0.0500 0.0200 99.4 3.5
4.470-3.650 0.0390 0.0500 0.0300 99.2 3.2
3.650-3.160 0.0530 0.0800 0.0400 98.7 3.4
3.160-2.830 0.0680 0.1000 0.0500 98.9 3.5
2.830-2.580 0.0990 0.1400 0.0700 97.0 3.5
2.580-2.390 0.1380 0.1900 0.1000 97.0 3.5
2.390-2.240 0.1920 0.2700 0.1400 96.6 3.5
2.240-2.110 0.2730 0.3900 0.2000 95.9 3.5
2.110-2.000 0.4260 0.6100 0.3200 94.6 3.5