Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "008260e517e8c9ca21bb9c05ed4c5d8a",
"space_group_name": "P 31 1 2",
"unit_cell": {
"a": 125.583,
"b": 125.583,
"c": 131.024,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40,2.80],
"number_observations_unique": 28591,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 12.6
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.90,2.80],
"number_observations_unique": 2856,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.566
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 97.2
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.551
}
]
}
]
}