Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8cc99ac43719ed062db9b3c29fe0c07b",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 62.040,
"b": 92.061,
"c": 161.998,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [92.07,2.15],
"number_observations": 275861,
"number_observations_unique": 96306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 99.47
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.227,2.15],
"number_observations_unique": 22734,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.748
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.617
}
]
}
]
}