Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1e3f573b877893de3e9dbdb7189cce3f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 71.712,
"b": 39.680,
"c": 108.108,
"alpha": 90.000,
"beta": 108.848,
"gamma": 90.000
},
"wavelengths": [0.97923],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.87,2.4],
"number_observations_unique": 22971,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 11.1
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.49,2.4],
"number_observations_unique": 2406,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.877
},
{
"type": "R(pim)",
"value": 0.616
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.614
}
]
}
]
}