Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b00a8efb22e376b17b2e9c26631c6add",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 49.406,
"b": 65.073,
"c": 77.769,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.91,1.12],
"number_observations_unique": 95694,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 32.9
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.16,1.12],
"number_observations_unique": 9219,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.1
},
{
"type": "R(pim)",
"value": 0.411
},
{
"type": "Completeness",
"value": 96.3
},
{
"type": "Redundancy",
"value": 9.9
},
{
"type": "CC(1/2)",
"value": 0.707
}
]
}
]
}