Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "70dc49cc0f0a32e13aaeb8bcb28a3421",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 119.72,
"b": 80.30,
"c": 122.65,
"alpha": 90.00,
"beta": 107.58,
"gamma": 90.00
},
"wavelengths": [1.03317],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.97,1.60],
"number_observations_unique": 145724,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 15.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.64,1.60],
"number_observations_unique": 10779,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.016
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.748
}
]
}
]
}