Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9ed2e25d1214d2e6ab9b3784045f3182",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 40.542,
"b": 89.875,
"c": 41.340,
"alpha": 90.00,
"beta": 113.96,
"gamma": 90.00
},
"wavelengths": [0.68880],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.938,1.116],
"number_observations_unique": 190922,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 8.9
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.136,1.116],
"number_observations_unique": 5145,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.565
},
{
"type": "R(meas)",
"value": 0.683
},
{
"type": "R(pim)",
"value": 0.380
},
{
"type": "CC(1/2)",
"value": 0.736
}
]
}
]
}