Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8305af4cb1df6930b5f761c63b1c90c6",
"space_group_name": "P 1",
"unit_cell": {
"a": 36.85,
"b": 42.44,
"c": 49.53,
"alpha": 108.54,
"beta": 99.15,
"gamma": 89.28
},
"wavelengths": [0.87290],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.328,1.70],
"number_observations_unique": 29970,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 11.03
},
{
"type": "Completeness",
"value": 97.07
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.70],
"number_observations_unique": 2956,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.98
},
{
"type": "I/SigI",
"value": 1.11
},
{
"type": "Completeness",
"value": 96.07
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.52
}
]
}
]
}