Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c72280f590f03f63b405c6b33c723ef0",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 32.73,
"b": 39.12,
"c": 46.54,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.65250,3.18000,4.22000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.05],
"number_observations_unique": 28534,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 32.5
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.1
}
]
},
"refln_shells": [
{
"resolution_limits": [1.09,1.05],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.638
},
{
"type": "I/SigI",
"value": 2.66
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.5
}
]
},
{
"resolution_limits": [1.90,1.80],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "I/SigI",
"value": 6.6
},
{
"type": "Completeness",
"value": 71.4
}
]
}
]
}