Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "45807fbe092b497673cec5e679809faa",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 108.13,
"b": 108.13,
"c": 221.31,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97853],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.39,1.80],
"number_observations": 2760557,
"number_observations_unique": 139108,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 20.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 19.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.85,1.80],
"number_observations": 183066,
"number_observations_unique": 10137,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.594
},
{
"type": "R(meas)",
"value": 1.640
},
{
"type": "R(pim)",
"value": 0.385
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Redundancy",
"value": 18.1
},
{
"type": "CC(1/2)",
"value": 0.741
}
]
}
]
}