Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2d9c78c11a8e7ba38bff8427b96a40d1",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 141.496,
"b": 53.910,
"c": 117.063,
"alpha": 90.00,
"beta": 121.37,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.23],
"number_observations_unique": 27557,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.23
},
{
"type": "I/SigI",
"value": 4.33
},
{
"type": "Completeness",
"value": 74.62
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.879
}
]
},
"refln_shells": [
{
"resolution_limits": [2.31,2.23],
"number_observations_unique": 1285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.53
},
{
"type": "I/SigI",
"value": 1.68
},
{
"type": "Completeness",
"value": 35.56
},
{
"type": "Redundancy",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.908
}
]
}
]
}