Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5a06ab008ed09dd904b929fddf2460a2",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 126.321,
"b": 158.985,
"c": 101.326,
"alpha": 90.00,
"beta": 124.65,
"gamma": 90.00
},
"wavelengths": [0.93000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,3.11],
"number_observations_unique": 29184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.202
},
{
"type": "I/SigI",
"value": 8.16
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 6.78
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [3.21,3.11],
"number_observations_unique": 2342,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.681
},
{
"type": "I/SigI",
"value": 1.03
},
{
"type": "Completeness",
"value": 79.2
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.605
}
]
}
]
}