Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bcb758e7a6a8ce268588bf99643ffb0b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 59.890,
"b": 99.422,
"c": 109.179,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.71,2.5],
"number_observations_unique": 22792,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1343
},
{
"type": "R(meas)",
"value": 0.1404
},
{
"type": "R(pim)",
"value": 0.04009
},
{
"type": "I/SigI",
"value": 13.49
},
{
"type": "Completeness",
"value": 98.19
},
{
"type": "Redundancy",
"value": 11.6
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.589,2.5],
"number_observations_unique": 2104,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5342
},
{
"type": "R(meas)",
"value": 0.5765
},
{
"type": "R(pim)",
"value": 0.2083
},
{
"type": "I/SigI",
"value": 2.06
},
{
"type": "Completeness",
"value": 93.02
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.737
}
]
}
]
}