Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8c034e1a4b77e57dd8f75d490f6a2325",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 54.250,
"b": 65.553,
"c": 104.245,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99750,1.00550,1.00900,1.54180,1.65130,1.72000,1.74100],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.26,1.50],
"number_observations_unique": 55989,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 27.6
},
{
"type": "Completeness",
"value": 92.5
},
{
"type": "Redundancy",
"value": 25.8
}
]
},
"refln_shells": [
{
"resolution_limits": [1.55,1.50],
"number_observations_unique": 5098,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.63
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 85.5
},
{
"type": "Redundancy",
"value": 5.6
}
]
}
]
}