Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "02ebf00251f3d31faa984e26dbcd873f",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 85.124,
"b": 85.124,
"c": 113.797,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.56,3.56],
"number_observations_unique": 4762,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 18.1
},
{
"type": "Completeness",
"value": 88.2
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [4.05,3.56],
"number_observations_unique": 478,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.89
},
{
"type": "R(pim)",
"value": 0.0698
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.886
}
]
}
]
}