Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a7c565e7219bef1e9c096f8aca110bc1",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 75.027,
"b": 76.732,
"c": 53.261,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00799],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.64,1.45],
"number_observations": 661343,
"number_observations_unique": 53687,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "R(meas)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 16.3
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 12.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.45],
"number_observations": 53447,
"number_observations_unique": 6675,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.675
},
{
"type": "R(meas)",
"value": 0.722
},
{
"type": "R(pim)",
"value": 0.249
},
{
"type": "I/SigI",
"value": 2.8
},
{
"type": "Redundancy",
"value": 8.0
},
{
"type": "CC(1/2)",
"value": 0.878
}
]
}
]
}