Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7600413536193871a5ec6e58aafef42e",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.690,
"b": 88.690,
"c": 39.414,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.350,1.010],
"number_observations": 1029155,
"number_observations_unique": 160303,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 14.200
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.030,1.010],
"number_observations": 41048,
"number_observations_unique": 7776,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.540
},
{
"type": "R(meas)",
"value": 1.713
},
{
"type": "R(pim)",
"value": 0.726
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.701
}
]
},
{
"resolution_limits": [44.350,5.530],
"number_observations": 7196,
"number_observations_unique": 1065,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 51.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}