Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a98c0a7cb024181722b4e4df8f886bad",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 146.83,
"b": 98.44,
"c": 39.70,
"alpha": 90.00,
"beta": 95.79,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.810,2.220],
"number_observations_unique": 27508,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 90.300
},
{
"type": "Redundancy",
"value": 1.700
}
]
},
"refln_shells": [
{
"resolution_limits": [2.280,2.220],
"number_observations": 6115,
"number_observations_unique": 1861,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.237
},
{
"type": "I/SigI",
"value": 5.800
},
{
"type": "Completeness",
"value": 74.200
},
{
"type": "Redundancy",
"value": 1.400
}
]
},
{
"resolution_limits": [30.810,9.930],
"number_observations": 1024,
"number_observations_unique": 310,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 28.100
},
{
"type": "Completeness",
"value": 86.400
},
{
"type": "Redundancy",
"value": 1.600
}
]
}
]
}