Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5d0bc5a92d44a79839c3cde47c7e5fb2",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 126.419,
"b": 75.580,
"c": 48.680,
"alpha": 90.00,
"beta": 106.19,
"gamma": 90.00
},
"wavelengths": [0.97624],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [64.16,1.69],
"number_observations": 198543,
"number_observations_unique": 48910,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.145
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 6.9
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.69],
"number_observations": 25291,
"number_observations_unique": 7093,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.498
},
{
"type": "R(meas)",
"value": 0.585
},
{
"type": "R(pim)",
"value": 0.301
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.437
}
]
}
]
}