Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0bbd7da08d9eb73a2ebc1ed5957842cd",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 169.679,
"b": 31.523,
"c": 91.634,
"alpha": 90.00,
"beta": 110.59,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.71,1.94],
"number_observations_unique": 29047,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 17.8
},
{
"type": "Completeness",
"value": 84.8
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.02,1.94],
"number_observations_unique": 1162,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.678
},
{
"type": "R(pim)",
"value": 0.464
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "CC(1/2)",
"value": 0.723
}
]
}
]
}