Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dfd28804e41be57f82dcad7d07494157",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.107,
"b": 49.269,
"c": 83.740,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [83.740,1.950],
"number_observations_unique": 13591,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 13.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.950],
"number_observations_unique": 937,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.593
},
{
"type": "R(meas)",
"value": 1.681
},
{
"type": "R(pim)",
"value": 0.526
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 9.800
},
{
"type": "CC(1/2)",
"value": 0.816
}
]
}
]
}