Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1ea95cac030a35ca45e945cf35606390",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 171.29,
"b": 98.29,
"c": 100.52,
"alpha": 90.00,
"beta": 109.94,
"gamma": 90.00
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.6250,2.2499],
"number_observations_unique": 74331,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 9.390
},
{
"type": "Completeness",
"value": 99.800
}
]
},
"refln_shells": [
{
"resolution_limits": [2.310,2.2499],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.874
},
{
"type": "I/SigI",
"value": 1.660
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.370,2.310],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.684
},
{
"type": "I/SigI",
"value": 2.230
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.440,2.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.637
},
{
"type": "I/SigI",
"value": 2.470
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.520,2.440],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.538
},
{
"type": "I/SigI",
"value": 2.920
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.600,2.520],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.432
},
{
"type": "I/SigI",
"value": 3.600
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.690,2.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.347
},
{
"type": "I/SigI",
"value": 4.420
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.790,2.690],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.268
},
{
"type": "I/SigI",
"value": 5.580
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [2.900,2.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.214
},
{
"type": "I/SigI",
"value": 6.800
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [3.030,2.900],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "I/SigI",
"value": 8.480
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [3.180,3.030],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "I/SigI",
"value": 10.340
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [3.350,3.180],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 12.780
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [3.560,3.350],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 15.560
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [3.800,3.560],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 16.850
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [4.110,3.800],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 18.600
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [4.500,4.110],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 19.910
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [5.030,4.500],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 20.410
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [5.810,5.030],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 20.270
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [7.120,5.810],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 20.200
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [10.060,7.120],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 22.300
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [48.6250,10.060],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 23.210
},
{
"type": "Completeness",
"value": 98.900
}
]
}
]
}