Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4115ea68456ccdf305f1aa640748b41f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.52,
"b": 106.83,
"c": 144.33,
"alpha": 90.0,
"beta": 91.3,
"gamma": 90.0
},
"wavelengths": [0.97856],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.098,2.400],
"number_observations": 286070,
"number_observations_unique": 53172,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 17.830
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.380
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.460,2.400],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.536
},
{
"type": "I/SigI",
"value": 3.000
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 5.463
},
{
"type": "CC(1/2)",
"value": 0.902
}
]
},
{
"resolution_limits": [2.530,2.460],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.486
},
{
"type": "I/SigI",
"value": 3.400
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 5.455
},
{
"type": "CC(1/2)",
"value": 0.910
}
]
},
{
"resolution_limits": [2.600,2.530],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.418
},
{
"type": "I/SigI",
"value": 3.990
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 5.452
},
{
"type": "CC(1/2)",
"value": 0.922
}
]
},
{
"resolution_limits": [2.680,2.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.312
},
{
"type": "I/SigI",
"value": 5.220
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 5.437
},
{
"type": "CC(1/2)",
"value": 0.957
}
]
},
{
"resolution_limits": [2.770,2.680],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.264
},
{
"type": "I/SigI",
"value": 6.110
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 5.426
},
{
"type": "CC(1/2)",
"value": 0.967
}
]
},
{
"resolution_limits": [2.870,2.770],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.215
},
{
"type": "I/SigI",
"value": 7.410
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 5.421
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
{
"resolution_limits": [2.980,2.870],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.165
},
{
"type": "I/SigI",
"value": 9.680
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.405
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
{
"resolution_limits": [3.100,2.980],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.142
},
{
"type": "I/SigI",
"value": 11.440
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 5.412
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
{
"resolution_limits": [3.240,3.100],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 14.410
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 5.390
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
{
"resolution_limits": [3.390,3.240],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 18.600
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.394
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [3.580,3.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 23.130
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 5.354
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [3.790,3.580],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 27.050
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.361
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [4.060,3.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 33.160
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 5.370
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.380,4.060],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 38.290
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.340
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.800,4.380],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 41.660
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 5.331
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [5.370,4.800],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 40.760
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 5.324
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [6.200,5.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 38.750
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 5.301
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [7.590,6.200],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 42.270
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 5.225
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [10.730,7.590],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 48.920
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 5.111
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [48.098,10.730],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 44.380
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 4.537
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}