Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "04797765a6ce3f555c525df02b7cb6ec",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 52.173,
"b": 50.757,
"c": 77.425,
"alpha": 90.00,
"beta": 96.72,
"gamma": 90.00
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.81,1.25],
"number_observations_unique": 109876,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 15.1
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
"refln_shells": [
{
"resolution_limits": [1.33,1.25],
"number_observations_unique": 17072,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.16
},
{
"type": "R(meas)",
"value": 1.1
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 95.5
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.85
}
]
}
]
}