Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5564837598e7743ef14f7b31a4d55e44",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.621,
"b": 52.956,
"c": 44.667,
"alpha": 90.00,
"beta": 102.82,
"gamma": 90.00
},
"wavelengths": [0.91264],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.92,1.65],
"number_observations": 101450,
"number_observations_unique": 30670,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 15.6
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.65],
"number_observations": 5197,
"number_observations_unique": 1510,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.420
},
{
"type": "R(meas)",
"value": 1.680
},
{
"type": "R(pim)",
"value": 0.889
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.259
}
]
}
]
}