Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "195e1b05e9f73b280b6a7ceb62cd79b8",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 71.889,
"b": 52.382,
"c": 32.114,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54178],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.11,1.73],
"number_observations_unique": 12927,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 13.2
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.83,1.73],
"number_observations_unique": 1842,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.400
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 98.3
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.792
}
]
}
]
}