Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5525061b513ff2ccbe9d3a0371e76acb",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 70.42,
"b": 70.72,
"c": 74.26,
"alpha": 90.00,
"beta": 110.06,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.9],
"number_observations_unique": 15383,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.157
},
{
"type": "I/SigI",
"value": 9.08
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [3.07,2.9],
"number_observations_unique": 2452,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.196
},
{
"type": "I/SigI",
"value": 1.28
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.672
}
]
}
]
}