Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "129bf6adce38a50847cf4d6116f4444b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 110.558,
"b": 55.691,
"c": 48.808,
"alpha": 90.00,
"beta": 101.31,
"gamma": 90.00
},
"wavelengths": [1.54180,2.00000,4.16000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.21,2.0],
"number_observations_unique": 19852,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 13.9
},
{
"type": "Completeness",
"value": 96.3
},
{
"type": "Redundancy",
"value": 4.2
}
]
},
"refln_shells": [
{
"resolution_limits": [2.05,2.00],
"number_observations_unique": 1854,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.544
},
{
"type": "I/SigI",
"value": 1.90
},
{
"type": "Completeness",
"value": 93.3
},
{
"type": "Redundancy",
"value": 4.0
}
]
},
{
"resolution_limits": [2.49,2.40],
"number_observations_unique": 888,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.336
},
{
"type": "I/SigI",
"value": 3.10
},
{
"type": "Completeness",
"value": 77.4
},
{
"type": "Redundancy",
"value": 2.68
}
]
}
]
}