Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e257745e216de50d06b3c85672b89c13",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 95.170,
"b": 171.615,
"c": 226.424,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.87,1.98],
"number_observations_unique": 254864,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.12
},
{
"type": "R(pim)",
"value": 0.05
},
{
"type": "I/SigI",
"value": 16.1
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.01,1.98],
"number_observations_unique": 11594,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.0
},
{
"type": "R(pim)",
"value": 0.67
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "CC(1/2)",
"value": 0.459
}
]
}
]
}