Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "43a5f65383957f01a3f3e93b609250f3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.13,
"b": 106.25,
"c": 55.34,
"alpha": 90.00,
"beta": 91.13,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.13,1.85],
"number_observations_unique": 53663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [1.89,1.85],
"number_observations_unique": 3311,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.333
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "CC(1/2)",
"value": 0.674
}
]
}
]
}