Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "602e1547a21ea7946a699ae81ec45ff1",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.588,
"b": 94.139,
"c": 96.184,
"alpha": 90.000,
"beta": 96.635,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,2.10],
"number_observations_unique": 75036,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 14.3
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.16,2.10],
"number_observations_unique": 3313,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.431
},
{
"type": "R(meas)",
"value": 0.513
},
{
"type": "R(pim)",
"value": 0.276
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.882
}
]
}
]
}