Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "582e6ce198a3d299d641fd9a123f9eb2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 100.223,
"b": 54.984,
"c": 106.706,
"alpha": 90.00,
"beta": 115.63,
"gamma": 90.00
},
"wavelengths": [0.97626],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [96.29,2.28],
"number_observations_unique": 45417,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.237
},
{
"type": "R(pim)",
"value": 0.139
},
{
"type": "I/SigI",
"value": 3.7
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.899
}
]
},
"refln_shells": [
{
"resolution_limits": [2.34,2.28],
"number_observations_unique": 3518,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.665
},
{
"type": "R(pim)",
"value": 0.955
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.291
}
]
}
]
}