Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b82ddfc83f1237dec8ffcf914f71849d",
"space_group_name": "P 61",
"unit_cell": {
"a": 103.119,
"b": 103.119,
"c": 55.266,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.99,1.36],
"number_observations_unique": 71819,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 16.6
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 20.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.41,1.36],
"number_observations": 128866,
"number_observations_unique": 6994,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.650
},
{
"type": "R(meas)",
"value": 2.725
},
{
"type": "R(pim)",
"value": 0.628
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 18.4
},
{
"type": "CC(1/2)",
"value": 0.639
}
]
}
]
}