Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "33e5f66be942d02da05df2459ad552fc",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 71.001,
"b": 64.779,
"c": 84.586,
"alpha": 90.0,
"beta": 106.3,
"gamma": 90.0
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [64.78,2.10],
"number_observations_unique": 42000,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.16,2.10],
"number_observations_unique": 3512,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.422
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.724
}
]
}
]
}