Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ebf7b55f246db7ebdda83832064f0a7d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.348,
"b": 41.587,
"c": 72.471,
"alpha": 90.00,
"beta": 104.38,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.02,1.32],
"number_observations_unique": 55708,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 8.2
},
{
"type": "Completeness",
"value": 95.9
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.34,1.32],
"number_observations_unique": 3701,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.069
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 90.8
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.350
}
]
}
]
}