Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b85c69a6badd198c4a8cdf787f3b1eaa",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.420,
"b": 53.108,
"c": 44.495,
"alpha": 90.00,
"beta": 103.12,
"gamma": 90.00
},
"wavelengths": [0.91267],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.24,1.50],
"number_observations": 123266,
"number_observations_unique": 41223,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.116
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 8.8
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.52,1.50],
"number_observations": 4781,
"number_observations_unique": 1977,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.070
},
{
"type": "R(meas)",
"value": 1.369
},
{
"type": "R(pim)",
"value": 0.843
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.246
}
]
}
]
}