Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "db95ac63cc72ef9a8bf759d77ec657ab",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.802,
"b": 88.802,
"c": 39.479,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.400,1.030],
"number_observations": 981475,
"number_observations_unique": 151766,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 9.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.050,1.030],
"number_observations": 43571,
"number_observations_unique": 7213,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.130
},
{
"type": "R(meas)",
"value": 2.332
},
{
"type": "R(pim)",
"value": 0.932
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.343
}
]
},
{
"resolution_limits": [44.400,5.640],
"number_observations": 6854,
"number_observations_unique": 1003,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 31.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}