Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bcd3130ccb1c735435ceb6a7c3746a98",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.615,
"b": 42.615,
"c": 216.818,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.200,2.190],
"number_observations": 279044,
"number_observations_unique": 11234,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.219
},
{
"type": "R(meas)",
"value": 0.223
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 11.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.310,2.190],
"number_observations": 40756,
"number_observations_unique": 1581,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.327
},
{
"type": "R(meas)",
"value": 5.432
},
{
"type": "R(pim)",
"value": 1.057
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.800
},
{
"type": "CC(1/2)",
"value": 0.797
}
]
},
{
"resolution_limits": [54.200,6.930],
"number_observations": 8405,
"number_observations_unique": 458,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 36.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 18.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}