Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "8ac48201603cb09064f618b81c317b92",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.75,
"b": 81.75,
"c": 134.82,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.940,1.810],
"number_observations": 961920,
"number_observations_unique": 48222,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 22.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.860,1.810],
"number_observations": 70514,
"number_observations_unique": 3520,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.405
},
{
"type": "R(meas)",
"value": 2.467
},
{
"type": "R(pim)",
"value": 0.549
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 0.752
}
]
},
{
"resolution_limits": [37.940,8.090],
"number_observations": 9675,
"number_observations_unique": 618,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 67.800
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 15.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}