Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "09217e680c8aeebde6c47aba6ca19d21",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.263,
"b": 41.542,
"c": 71.972,
"alpha": 90.000,
"beta": 104.388,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.94,1.408],
"number_observations_unique": 46067,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.43,1.41],
"number_observations_unique": 2108,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.238
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 92.5
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.523
}
]
}
]
}