Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9e0359886777fb297cea265998b9e46d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 49.514,
"b": 81.596,
"c": 116.427,
"alpha": 90.000,
"beta": 91.372,
"gamma": 90.000
},
"wavelengths": [1.04800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.38,2.43],
"number_observations_unique": 67489,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 10.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.52,2.43],
"number_observations_unique": 3709,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.531
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.691
}
]
}
]
}