Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8bb549cd5f4cf87c33086bb37e780bad",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 53.05,
"b": 123.79,
"c": 55.10,
"alpha": 90.00,
"beta": 113.52,
"gamma": 90.00
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.14,1.90],
"number_observations_unique": 39267,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 5.2
},
{
"type": "Completeness",
"value": 77.9
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [1.968,1.90],
"number_observations_unique": 3884,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.271
},
{
"type": "R(pim)",
"value": 0.231
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.829
}
]
}
]
}