Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "effd78e11dec1137eec889dd030b0cee",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 85.298,
"b": 107.197,
"c": 142.066,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.640,2.400],
"number_observations": 299707,
"number_observations_unique": 51577,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.198
},
{
"type": "R(meas)",
"value": 0.217
},
{
"type": "R(pim)",
"value": 0.088
},
{
"type": "I/SigI",
"value": 7.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.470,2.400],
"number_observations": 26375,
"number_observations_unique": 4422,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.962
},
{
"type": "R(meas)",
"value": 2.146
},
{
"type": "R(pim)",
"value": 0.859
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.536
}
]
},
{
"resolution_limits": [48.640,9.900],
"number_observations": 4308,
"number_observations_unique": 812,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 23.800
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}