Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3611d78da6cdf3bc01d6244e3b748a18",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 39.979,
"b": 56.660,
"c": 89.479,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97916],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.0],
"number_observations_unique": 13399,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "I/SigI",
"value": 18.3
},
{
"type": "Completeness",
"value": 94.1
},
{
"type": "Redundancy",
"value": 8.5
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.03,2.0],
"number_observations_unique": 477,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.767
},
{
"type": "I/SigI",
"value": 1.35
},
{
"type": "Completeness",
"value": 66.9
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.623
}
]
}
]
}