Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e03a93f33c88e163a7f71d211a95bd6c",
"space_group_name": "P 61",
"unit_cell": {
"a": 98.24,
"b": 98.24,
"c": 82.01,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.0,1.620],
"number_observations_unique": 56801,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 20.220
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.660,1.620],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.798
},
{
"type": "I/SigI",
"value": 2.720
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.710,1.660],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.705
},
{
"type": "I/SigI",
"value": 3.190
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.760,1.710],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.580
},
{
"type": "I/SigI",
"value": 4.110
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.810,1.760],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.481
},
{
"type": "I/SigI",
"value": 4.970
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.870,1.810],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.418
},
{
"type": "I/SigI",
"value": 5.940
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [1.940,1.870],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.353
},
{
"type": "I/SigI",
"value": 7.560
},
{
"type": "Completeness",
"value": 97.300
}
]
},
{
"resolution_limits": [2.010,1.940],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.245
},
{
"type": "I/SigI",
"value": 10.270
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.090,2.010],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.226
},
{
"type": "I/SigI",
"value": 12.170
},
{
"type": "Completeness",
"value": 99.200
}
]
},
{
"resolution_limits": [2.180,2.090],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.143
},
{
"type": "I/SigI",
"value": 16.180
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.290,2.180],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "I/SigI",
"value": 18.290
},
{
"type": "Completeness",
"value": 98.600
}
]
},
{
"resolution_limits": [2.410,2.290],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "I/SigI",
"value": 23.650
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.560,2.410],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 26.370
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.740,2.560],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 30.450
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [2.960,2.740],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 37.230
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [3.240,2.960],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 45.310
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [3.620,3.240],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 53.550
},
{
"type": "Completeness",
"value": 99.500
}
]
},
{
"resolution_limits": [4.180,3.620],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 59.020
},
{
"type": "Completeness",
"value": 98.700
}
]
},
{
"resolution_limits": [5.120,4.180],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 66.800
},
{
"type": "Completeness",
"value": 99.200
}
]
},
{
"resolution_limits": [7.240,5.120],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 65.680
},
{
"type": "Completeness",
"value": 99.000
}
]
},
{
"resolution_limits": [20.0,7.240],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 72.850
},
{
"type": "Completeness",
"value": 93.000
}
]
}
]
}