Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8b628772d6ec4492e7bb05cebc1b06c0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.606,
"b": 80.441,
"c": 76.076,
"alpha": 90.00,
"beta": 102.73,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.54,1.94],
"number_observations_unique": 38130,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.07
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 3
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.01,1.94],
"number_observations_unique": 2269,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.274
},
{
"type": "R(pim)",
"value": 0.228
},
{
"type": "I/SigI",
"value": 1
},
{
"type": "CC(1/2)",
"value": 0.673
}
]
}
]
}