Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "07c376faacaf66814a82229e7bf5c749",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.14,
"b": 47.40,
"c": 80.91,
"alpha": 90.00,
"beta": 99.08,
"gamma": 90.00
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.520,1.650],
"number_observations": 108570,
"number_observations_unique": 44841,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 16.200
},
{
"type": "Completeness",
"value": 85.500
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.690,1.650],
"number_observations_unique": 1693,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.367
},
{
"type": "R(meas)",
"value": 0.500
},
{
"type": "R(pim)",
"value": 0.337
},
{
"type": "Completeness",
"value": 44.200
},
{
"type": "Redundancy",
"value": 1.500
},
{
"type": "CC(1/2)",
"value": 0.625
}
]
},
{
"resolution_limits": [35.520,7.380],
"number_observations_unique": 567,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "Completeness",
"value": 89.600
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}