Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "933a2fe70b25c11b92031e0b309078cc",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 95.571,
"b": 56.096,
"c": 72.693,
"alpha": 90.00,
"beta": 125.34,
"gamma": 90.00
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.89,1.29],
"number_observations_unique": 73659,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 94.4
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.32,1.30],
"number_observations_unique": 2304,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.912
},
{
"type": "R(pim)",
"value": 0.652
},
{
"type": "CC(1/2)",
"value": 0.332
}
]
}
]
}