Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a2c7693797c45699144426a72ebfdac1",
"space_group_name": "P 1",
"unit_cell": {
"a": 69.378,
"b": 69.641,
"c": 73.146,
"alpha": 117.48,
"beta": 93.25,
"gamma": 98.27
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.740,2.300],
"number_observations": 183332,
"number_observations_unique": 51695,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.370,2.300],
"number_observations": 16253,
"number_observations_unique": 4456,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.754
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.698
}
]
},
{
"resolution_limits": [46.740,9.480],
"number_observations": 2760,
"number_observations_unique": 746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 28.300
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}