Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ef1cd60bb7e456115d8ad00c3b5ebfdf",
"space_group_name": "P 1",
"unit_cell": {
"a": 46.674,
"b": 63.568,
"c": 87.242,
"alpha": 84.39,
"beta": 85.51,
"gamma": 80.09
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.69,1.89],
"number_observations_unique": 74530,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 10.9
},
{
"type": "Completeness",
"value": 95.6
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 1.00
}
]
},
"refln_shells": [
{
"resolution_limits": [2.00,1.89],
"number_observations_unique": 9836,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.437
},
{
"type": "R(pim)",
"value": 0.275
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.85
}
]
}
]
}