Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "05dcf393fe41b9afb7cc8d7c6acc68b2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 96.16,
"b": 96.04,
"c": 97.82,
"alpha": 90.000,
"beta": 92.806,
"gamma": 90.000
},
"wavelengths": [1.02500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.15],
"number_observations_unique": 96459,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.239
},
{
"type": "I/SigI",
"value": 6.14
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.69
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.15],
"number_observations_unique": 15372,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.988
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 5.63
},
{
"type": "CC(1/2)",
"value": 0.421
}
]
}
]
}