Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8ac283ef9e650e2c8f1acc7be2f2b1e6",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.123,
"b": 71.123,
"c": 150.531,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.300,2.540],
"number_observations": 168128,
"number_observations_unique": 13392,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.193
},
{
"type": "R(meas)",
"value": 0.202
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 15.000
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.650,2.540],
"number_observations": 18242,
"number_observations_unique": 1503,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.143
},
{
"type": "R(meas)",
"value": 1.193
},
{
"type": "R(pim)",
"value": 0.333
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 93.600
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 0.775
}
]
},
{
"resolution_limits": [29.300,8.790],
"number_observations": 4070,
"number_observations_unique": 388,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 57.700
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}