Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dba4875dc3f945f3ce69cefa92f2cf99",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 86.309,
"b": 57.022,
"c": 110.198,
"alpha": 90.00,
"beta": 94.63,
"gamma": 90.00
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.548,1.89],
"number_observations_unique": 85679,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 14.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.99,1.89],
"number_observations_unique": 12438,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.580
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.812
}
]
}
]
}