Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e157b6081767ba48fc86ed625f9f2caf",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.060,
"b": 95.631,
"c": 40.916,
"alpha": 90.000,
"beta": 108.576,
"gamma": 90.000
},
"wavelengths": [1.54184],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [95.63,1.99],
"number_observations_unique": 18932,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 4.87
},
{
"type": "Completeness",
"value": 97.0
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.06,1.99],
"number_observations_unique": 1843,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.216
},
{
"type": "R(pim)",
"value": 0.133
},
{
"type": "CC(1/2)",
"value": 0.902
}
]
}
]
}