Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5cd8af2e2fe5c53271f1978b35af9467",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.01,
"b": 49.44,
"c": 57.94,
"alpha": 90.00,
"beta": 93.79,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.44,1.55],
"number_observations_unique": 36086,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "I/SigI",
"value": 10.8
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.55],
"number_observations_unique": 5168,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.594
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.717
}
]
}
]
}