Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "156d8b6c134132c2dc65c30260231fe3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.114,
"b": 101.468,
"c": 142.118,
"alpha": 90.00,
"beta": 99.41,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.29,2.14],
"number_observations_unique": 89600,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.18,2.14],
"number_observations_unique": 4579,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.047
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 7
},
{
"type": "CC(1/2)",
"value": 0.397
}
]
}
]
}