Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c2040396bd1b433f3c5ee706f6794a4a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 198.22,
"b": 117.60,
"c": 115.21,
"alpha": 90.00,
"beta": 123.79,
"gamma": 90.00
},
"wavelengths": [1.07195],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.6],
"number_observations_unique": 66071,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.67,2.60],
"number_observations_unique": 4346,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.559
},
{
"type": "I/SigI",
"value": 0.33
},
{
"type": "Completeness",
"value": 85.8
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.16
}
]
}
]
}