Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "10b7ad041df0bcf0f636d891cee80a89",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 54.588,
"b": 89.452,
"c": 342.772,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.6,1.916],
"number_observations_unique": 48616,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.114
},
{
"type": "I/SigI",
"value": 8.8
},
{
"type": "Completeness",
"value": 89.3
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.053,1.916],
"number_observations_unique": 2432,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.833
},
{
"type": "R(meas)",
"value": 0.429
},
{
"type": "R(pim)",
"value": 0.993
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.563
}
]
}
]
}