Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b35c5f36ac61a1ae6506f53551cf796a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.87,
"b": 125.75,
"c": 49.71,
"alpha": 90.00,
"beta": 116.78,
"gamma": 90.00
},
"wavelengths": [0.99700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.17,1.72],
"number_observations_unique": 51864,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 86.0
}
]
},
"refln_shells": [
{
"resolution_limits": [1.81,1.72],
"number_observations_unique": 7532,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.528
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 99.8
}
]
},
{
"resolution_limits": [38.17,5.44],
"number_observations_unique": 1676,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 23.7
},
{
"type": "Completeness",
"value": 99.7
}
]
}
]
}