Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f2f1fdf7217a4e1fbadfabc61652ce31",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.030,
"b": 71.062,
"c": 91.586,
"alpha": 92.16,
"beta": 96.16,
"gamma": 101.94
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.95],
"number_observations_unique": 85945,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 10.21
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.941
}
]
},
"refln_shells": [
{
"resolution_limits": [2.02,1.95],
"number_observations_unique": 8478,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5
},
{
"type": "I/SigI",
"value": 2.51
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.932
}
]
}
]
}