Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3db3fd37e8558c1b84af5e7c8c09f6b3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 76.555,
"b": 83.558,
"c": 61.658,
"alpha": 90.00,
"beta": 100.89,
"gamma": 90.00
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.644],
"number_observations_unique": 46072,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 17.9
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.65],
"number_observations_unique": 2346,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.441
},
{
"type": "CC(1/2)",
"value": 0.877
}
]
}
]
}