Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4cfdd6db3b9b34a758792aa62d7274b3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 53.876,
"b": 44.851,
"c": 93.788,
"alpha": 90.00,
"beta": 103.44,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [91.22,1.56],
"number_observations_unique": 62074,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 99.45
},
{
"type": "Redundancy",
"value": 5.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.59,1.56],
"number_observations_unique": 2856,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.425
},
{
"type": "R(meas)",
"value": 0.480
},
{
"type": "R(pim)",
"value": 0.218
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.912
}
]
}
]
}