Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "06df8bc62dc531d8f8fc48912b9dc48e",
"space_group_name": "P 41 3 2",
"unit_cell": {
"a": 112.224,
"b": 112.224,
"c": 112.224,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.7,2.3],
"number_observations_unique": 11334,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.142
},
{
"type": "R(meas)",
"value": 0.146
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 16.05
},
{
"type": "Completeness",
"value": 99.95
},
{
"type": "Redundancy",
"value": 21.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.5,2.3],
"number_observations_unique": 5107,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.306
},
{
"type": "R(meas)",
"value": 3.39
},
{
"type": "R(pim)",
"value": 0.745
},
{
"type": "I/SigI",
"value": 1.08
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 20.7
},
{
"type": "CC(1/2)",
"value": 0.464
}
]
}
]
}