Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ba7b79684e50ab3ed0cda546813d885d",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 107.568,
"b": 107.568,
"c": 100.139,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.03321],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [93.16,1.61],
"number_observations_unique": 43754,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 24.97
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 28.3
}
]
},
"refln_shells": [
{
"resolution_limits": [1.65,1.61],
"number_observations_unique": 18102,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.662
},
{
"type": "R(pim)",
"value": 0.657
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 80.2
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.355
}
]
}
]
}