Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8509321c7b5bfef43032d55394a6b5fd",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.639,
"b": 147.949,
"c": 64.725,
"alpha": 90.00,
"beta": 100.16,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.97,1.94],
"number_observations": 263714,
"number_observations_unique": 79417,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 13.8
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.04,1.94],
"number_observations": 39684,
"number_observations_unique": 11672,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.559
},
{
"type": "R(meas)",
"value": 0.663
},
{
"type": "R(pim)",
"value": 0.354
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.758
}
]
}
]
}