Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "44d5bb7c63b826a75429228d21fc5893",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 48.73,
"b": 61.32,
"c": 65.84,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.730,1.560],
"number_observations": 181138,
"number_observations_unique": 28648,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 20.200
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.600,1.560],
"number_observations": 13927,
"number_observations_unique": 2086,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.546
},
{
"type": "R(meas)",
"value": 1.677
},
{
"type": "R(pim)",
"value": 0.644
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.667
}
]
},
{
"resolution_limits": [48.730,6.980],
"number_observations": 2171,
"number_observations_unique": 382,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(meas)",
"value": 0.021
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 69.300
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}