Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cf1bf8c20b16cfd7f9f10cd1128e4f97",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 108.08,
"b": 122.42,
"c": 61.24,
"alpha": 90.00,
"beta": 105.55,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.1,2.2],
"number_observations_unique": 38888,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0480
},
{
"type": "I/SigI",
"value": 15.41
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.90
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.30,2.20],
"number_observations_unique": 4828,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5922
},
{
"type": "I/SigI",
"value": 2.18
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 7.04
},
{
"type": "CC(1/2)",
"value": 0.85
}
]
}
]
}