Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2537ca40b7989d1989f2b710aae5a064",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 52.346,
"b": 112.065,
"c": 165.542,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.75],
"number_observations_unique": 97669,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 10.8
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.80,1.75],
"number_observations_unique": 4423,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.004
},
{
"type": "R(pim)",
"value": 1.423
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Completeness",
"value": 92.6
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.527
}
]
}
]
}