Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "baaf476a1ae42463e6d8f7ff0ebb7431",
"space_group_name": "I 4",
"unit_cell": {
"a": 171.429,
"b": 171.429,
"c": 40.591,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.860,2.100],
"number_observations": 233850,
"number_observations_unique": 34988,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 11.100
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.100],
"number_observations": 18814,
"number_observations_unique": 2862,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.981
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.802
}
]
},
{
"resolution_limits": [42.860,8.910],
"number_observations": 3156,
"number_observations_unique": 504,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 28.100
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}