Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8bd5e02b76825582eea02619dece0d01",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 127.773,
"b": 46.836,
"c": 174.916,
"alpha": 90.0,
"beta": 108.2,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [83.08,2.000],
"number_observations_unique": 66960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.410
},
{
"type": "I/SigI",
"value": 4.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.903
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 5.659
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.027
}
]
},
{
"resolution_limits": [83.080,9.380],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
}
]
}