Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "54ad8768757d0e11b5a26287a39eda1d",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 65.19,
"b": 65.19,
"c": 307.71,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.400],
"number_observations_unique": 27225,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 21.490
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 7.025
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.460,2.400],
"number_observations_unique": 1952,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.558
},
{
"type": "R(meas)",
"value": 0.600
},
{
"type": "I/SigI",
"value": 3.290
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.352
},
{
"type": "CC(1/2)",
"value": 0.933
}
]
},
{
"resolution_limits": [2.530,2.460],
"number_observations_unique": 1915,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.481
},
{
"type": "R(meas)",
"value": 0.518
},
{
"type": "I/SigI",
"value": 3.930
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.276
},
{
"type": "CC(1/2)",
"value": 0.931
}
]
},
{
"resolution_limits": [2.600,2.530],
"number_observations_unique": 1883,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.409
},
{
"type": "R(meas)",
"value": 0.440
},
{
"type": "I/SigI",
"value": 4.580
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.252
},
{
"type": "CC(1/2)",
"value": 0.953
}
]
},
{
"resolution_limits": [2.680,2.600],
"number_observations_unique": 1783,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.327
},
{
"type": "R(meas)",
"value": 0.352
},
{
"type": "I/SigI",
"value": 5.810
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.354
},
{
"type": "CC(1/2)",
"value": 0.966
}
]
},
{
"resolution_limits": [2.770,2.680],
"number_observations_unique": 1751,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.271
},
{
"type": "R(meas)",
"value": 0.293
},
{
"type": "I/SigI",
"value": 6.950
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.272
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
{
"resolution_limits": [2.870,2.770],
"number_observations_unique": 1725,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.197
},
{
"type": "R(meas)",
"value": 0.212
},
{
"type": "I/SigI",
"value": 9.240
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.243
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
{
"resolution_limits": [2.980,2.870],
"number_observations_unique": 1670,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "R(meas)",
"value": 0.168
},
{
"type": "I/SigI",
"value": 11.670
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.226
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
{
"resolution_limits": [3.100,2.980],
"number_observations_unique": 1590,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.122
},
{
"type": "I/SigI",
"value": 15.640
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.212
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [3.240,3.100],
"number_observations_unique": 1507,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 19.250
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.228
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [3.390,3.240],
"number_observations_unique": 1476,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 24.170
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.054
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [3.580,3.390],
"number_observations_unique": 1404,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 30.370
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.039
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [3.790,3.580],
"number_observations_unique": 1333,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 36.210
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.951
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.060,3.790],
"number_observations_unique": 1268,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 38.860
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.710
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.380,4.060],
"number_observations_unique": 1184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 43.210
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.710
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.800,4.380],
"number_observations_unique": 1095,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 46.430
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.657
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [5.370,4.800],
"number_observations_unique": 1009,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 46.970
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.605
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [6.200,5.370],
"number_observations_unique": 894,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 43.850
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.546
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [7.590,6.200],
"number_observations_unique": 779,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 45.280
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 6.317
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [10.730,7.590],
"number_observations_unique": 626,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 51.880
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 6.094
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [50,10.730],
"number_observations_unique": 381,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 48.630
},
{
"type": "Completeness",
"value": 92.000
},
{
"type": "Redundancy",
"value": 5.231
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}