Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6bf1558fb1e450aa1c9a5e56719f5511",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.131,
"b": 82.814,
"c": 94.446,
"alpha": 90.00,
"beta": 91.58,
"gamma": 90.00
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.05,1.80],
"number_observations_unique": 76390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 23.3
},
{
"type": "Completeness",
"value": 92.2
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.80],
"number_observations_unique": 2744,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.105
},
{
"type": "I/SigI",
"value": 7.6
},
{
"type": "Completeness",
"value": 56.4
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
}
]
}