Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1bb2e34ba5aabe7ef0d93842d46f4326",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 59.482,
"b": 120.081,
"c": 169.468,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.000,3.188],
"number_observations_unique": 9751,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.159
},
{
"type": "I/SigI",
"value": 9.8000
},
{
"type": "Completeness",
"value": 93.5
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [3.29,3.20],
"number_observations_unique": 800,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.28
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 96.5
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.391
}
]
}
]
}