Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1d81fa76d2108332f46b0c2facb3b474",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 128.476,
"b": 186.340,
"c": 200.684,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.850,2.500],
"number_observations": 537539,
"number_observations_unique": 83211,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.175
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.550,2.500],
"number_observations": 24590,
"number_observations_unique": 4504,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.168
},
{
"type": "R(pim)",
"value": 0.554
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.589
}
]
},
{
"resolution_limits": [48.850,12.990],
"number_observations": 3952,
"number_observations_unique": 654,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 36.600
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}