Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "df1458f1c7b3c04246bcbc85cd6be2c7",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 154.629,
"b": 154.629,
"c": 156.506,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.99997],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [156.506,2.954],
"number_observations": 999784,
"number_observations_unique": 45801,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "R(meas)",
"value": 0.109
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 25.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.964,2.954],
"number_observations": 10758,
"number_observations_unique": 478,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.792
},
{
"type": "R(meas)",
"value": 1.833
},
{
"type": "R(pim)",
"value": 0.385
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.500
},
{
"type": "CC(1/2)",
"value": 0.756
}
]
},
{
"resolution_limits": [156.506,13.709],
"number_observations": 8858,
"number_observations_unique": 522,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 66.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}