Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dc1ee5580e573dd5ccb03d5fad9be922",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 51.193,
"b": 142.985,
"c": 85.441,
"alpha": 90.000,
"beta": 92.904,
"gamma": 90.000
},
"wavelengths": [0.97850],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.66,1.90],
"number_observations_unique": 96038,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.124
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 10.8
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.93,1.90],
"number_observations_unique": 4680,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.767
},
{
"type": "R(pim)",
"value": 0.324
},
{
"type": "CC(1/2)",
"value": 0.820
}
]
}
]
}