Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b1db393e46de2863bdf726a85f463cd2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.681,
"b": 91.242,
"c": 47.409,
"alpha": 90.00,
"beta": 117.64,
"gamma": 90.00
},
"wavelengths": [0.97011,0.97870,0.90500,0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [99.000,1.780],
"number_observations_unique": 32765,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 16.100
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 5.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.81,1.78],
"number_observations_unique": 1203,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.331
},
{
"type": "Completeness",
"value": 72.6
},
{
"type": "Redundancy",
"value": 4.20
}
]
}
]
}