Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e8da4648af31a7fcdf6cd4e81eb65803",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 119.749,
"b": 119.749,
"c": 78.705,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [119.750,2.150],
"number_observations": 760676,
"number_observations_unique": 31749,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 21.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.210,2.150],
"number_observations": 50441,
"number_observations_unique": 2558,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.666
},
{
"type": "R(meas)",
"value": 1.711
},
{
"type": "R(pim)",
"value": 0.382
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.700
},
{
"type": "CC(1/2)",
"value": 0.697
}
]
},
{
"resolution_limits": [119.750,9.120],
"number_observations": 8890,
"number_observations_unique": 506,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 69.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 17.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}