Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ae270e94ff1f35147ec23649a151585",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 100.059,
"b": 105.502,
"c": 120.190,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.661,1.7290],
"number_observations": 318157,
"number_observations_unique": 62875,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 22.600
},
{
"type": "Completeness",
"value": 94.700
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.760,1.730],
"number_observations": 11298,
"number_observations_unique": 2772,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.724
},
{
"type": "R(pim)",
"value": 0.385
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 77.700
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.348
}
]
},
{
"resolution_limits": [19.660,8.980],
"number_observations": 2197,
"number_observations_unique": 479,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.011
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 110.900
},
{
"type": "Completeness",
"value": 90.100
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}