Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fafe892c950e0f7c02cb679a2006e9eb",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.361,
"b": 53.982,
"c": 93.137,
"alpha": 90.00,
"beta": 104.84,
"gamma": 90.00
},
"wavelengths": [0.96546],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.032,1.937],
"number_observations_unique": 37441,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 10.0
},
{
"type": "Completeness",
"value": 94.0
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.970,1.937],
"number_observations_unique": 1854,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.341
},
{
"type": "R(meas)",
"value": 0.441
},
{
"type": "R(pim)",
"value": 0.276
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.826
}
]
}
]
}