Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3e558367ccaf92e770371dfdade07150",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 64.811,
"b": 118.873,
"c": 65.897,
"alpha": 90.00,
"beta": 92.93,
"gamma": 90.00
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.950,2.100],
"number_observations": 83516,
"number_observations_unique": 27636,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 15.700
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.100],
"number_observations": 3729,
"number_observations_unique": 1725,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.502
},
{
"type": "R(pim)",
"value": 0.402
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 72.400
},
{
"type": "Redundancy",
"value": 2.200
},
{
"type": "CC(1/2)",
"value": 0.690
}
]
},
{
"resolution_limits": [33.950,8.910],
"number_observations": 1105,
"number_observations_unique": 356,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 64.200
},
{
"type": "Completeness",
"value": 89.300
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}