Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d20e05ab5345f6ac563f444a9a80dc45",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 101.202,
"b": 104.378,
"c": 142.284,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96546],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.66,1.566],
"number_observations_unique": 105352,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 18.3
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.593,1.566],
"number_observations_unique": 5191,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.786
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.801
}
]
}
]
}