Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "fae04adf27498bcb0f19810db2ca9b9e",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.684,
"b": 88.684,
"c": 39.430,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.340,0.950],
"number_observations": 1289356,
"number_observations_unique": 191920,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 15.700
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [0.970,0.950],
"number_observations": 52447,
"number_observations_unique": 9108,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.681
},
{
"type": "R(meas)",
"value": 2.949
},
{
"type": "R(pim)",
"value": 1.205
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.365
}
]
},
{
"resolution_limits": [44.340,5.200],
"number_observations": 8568,
"number_observations_unique": 1268,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 60.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}