Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "800cc9daca2b7bc4ea17af1a23094e1b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 83.870,
"b": 85.613,
"c": 180.758,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96598],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.27,1.910],
"number_observations_unique": 100253,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 9.500
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.980,1.910],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.003
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.536
}
]
},
{
"resolution_limits": [49.270,7.400],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}