Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "a6e7da924155e110699714957cba57b9",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.452,
"b": 71.068,
"c": 102.878,
"alpha": 90.000,
"beta": 91.967,
"gamma": 90.000
},
"wavelengths": [0.88560],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [58.462,1.161],
"number_observations_unique": 119426,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.096
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 52
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.906
}
]
},
"refln_shells": [
{
"resolution_limits": [1.329,1.161],
"number_observations_unique": 5971,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.275
},
{
"type": "R(meas)",
"value": 1.436
},
{
"type": "R(pim)",
"value": 0.770
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.535
}
]
}
]
}