Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "92fbd64d82b95037da762504149c7f8c",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 48.632,
"b": 94.069,
"c": 103.916,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97911],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [103.920,2.500],
"number_observations": 320975,
"number_observations_unique": 16926,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.271
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 9.900
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 19.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.600,2.500],
"number_observations": 21993,
"number_observations_unique": 1623,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.716
},
{
"type": "R(pim)",
"value": 0.467
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 84.500
},
{
"type": "Redundancy",
"value": 13.600
},
{
"type": "CC(1/2)",
"value": 0.636
}
]
},
{
"resolution_limits": [103.920,9.010],
"number_observations": 7516,
"number_observations_unique": 445,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 31.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
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},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}