Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "358289ea9a686b5a0b63a08989ca6408",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 49.468,
"b": 99.812,
"c": 125.839,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.390,1.430],
"number_observations": 449512,
"number_observations_unique": 110558,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 12.600
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.480,1.430],
"number_observations_unique": 10616,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.839
},
{
"type": "R(meas)",
"value": 0.958
},
{
"type": "R(pim)",
"value": 0.450
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.535
}
]
},
{
"resolution_limits": [46.390,5.540],
"number_observations_unique": 1886,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "Completeness",
"value": 87.900
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}