Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "35cf1911bc5d5a6290a833125e5c7f2d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 68.504,
"b": 218.725,
"c": 68.572,
"alpha": 90.00,
"beta": 109.68,
"gamma": 90.00
},
"wavelengths": [1.03000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,3.25],
"number_observations_unique": 29281,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.143
},
{
"type": "I/SigI",
"value": 6.0
},
{
"type": "Completeness",
"value": 98.12
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [3.45,3.25],
"number_observations_unique": 2921,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.268
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 98.35
},
{
"type": "CC(1/2)",
"value": 0.312
}
]
}
]
}