Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9ca24d8cea1154aa4b885270406b8205",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.253,
"b": 56.382,
"c": 64.699,
"alpha": 90.00,
"beta": 94.36,
"gamma": 90.00
},
"wavelengths": [0.94055],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.00,1.42],
"number_observations": 393970,
"number_observations_unique": 57737,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "R(meas)",
"value": 0.133
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 7.3
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.44,1.42],
"number_observations": 20239,
"number_observations_unique": 2883,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.674
},
{
"type": "R(meas)",
"value": 3.972
},
{
"type": "R(pim)",
"value": 1.493
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.304
}
]
}
]
}