Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f811b4b7736e8e43923ffff3a7c0d4ec",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 338.328,
"b": 51.534,
"c": 159.899,
"alpha": 90.00,
"beta": 118.15,
"gamma": 90.00
},
"wavelengths": [0.97990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47,2.428],
"number_observations_unique": 84548,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0468
},
{
"type": "I/SigI",
"value": 17.44
},
{
"type": "Completeness",
"value": 90.74
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.515,2.428],
"number_observations_unique": 9161,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5307
},
{
"type": "I/SigI",
"value": 2.46
},
{
"type": "Completeness",
"value": 99.41
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.878
}
]
}
]
}