Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f5361166f2ce9f4c55a5e48e71de401d",
"space_group_name": "P 1",
"unit_cell": {
"a": 21.230,
"b": 21.905,
"c": 26.521,
"alpha": 105.85,
"beta": 112.44,
"gamma": 95.26
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [23.1,2.0],
"number_observations_unique": 2744,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 23.29
},
{
"type": "Completeness",
"value": 98.75
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.072,2.0],
"number_observations_unique": 270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1358
},
{
"type": "I/SigI",
"value": 10.42
},
{
"type": "Completeness",
"value": 99.26
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}