Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3827c5e7b2f3791ce420289f902f49fc",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 86.890,
"b": 86.890,
"c": 187.711,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97919],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [93.86,2.500],
"number_observations": 196222,
"number_observations_unique": 29209,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 12.4
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.600,2.500],
"number_observations": 22386,
"number_observations_unique": 3233,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.530
},
{
"type": "R(pim)",
"value": 0.231
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.860
}
]
},
{
"resolution_limits": [93.860,9.010],
"number_observations": 4195,
"number_observations_unique": 714,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 23.900
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}