Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "21a000a43e9aa6bc234ba3e0eebc74a3",
"space_group_name": "P 42 21 2",
"unit_cell": {
"a": 94.086,
"b": 94.086,
"c": 84.618,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.00,2.26],
"number_observations_unique": 17965,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 29.8
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 1.00
}
]
},
"refln_shells": [
{
"resolution_limits": [2.31,2.27],
"number_observations_unique": 726,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.147
},
{
"type": "R(pim)",
"value": 0.357
},
{
"type": "I/SigI",
"value": 1.10
},
{
"type": "Completeness",
"value": 80.2
},
{
"type": "Redundancy",
"value": 9.9
},
{
"type": "CC(1/2)",
"value": 0.798
}
]
}
]
}