Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "72233b0850ae3640e3e281b17b1d40f8",
"space_group_name": "P 32",
"unit_cell": {
"a": 43.635,
"b": 43.635,
"c": 97.480,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97925],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.79,1.4],
"number_observations_unique": 40810,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 18.5
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 8.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [37.79,3.808],
"number_observations_unique": 2043,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 3.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 8.5
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [1.424,1.4],
"number_observations_unique": 2045,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.579
},
{
"type": "R(meas)",
"value": 0.619
},
{
"type": "R(pim)",
"value": 0.326
},
{
"type": "CC(1/2)",
"value": 0.922
}
]
}
]
}