Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2480bfc00179d7bd0dea4fe823f2b243",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.13,
"b": 63.22,
"c": 45.38,
"alpha": 90.00,
"beta": 112.93,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.79,1.72],
"number_observations_unique": 20977,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [1.82,1.72],
"number_observations_unique": 3046,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.167
},
{
"type": "CC(1/2)",
"value": 0.967
}
]
}
]
}