Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e7d264beaddc89df2803cdea06949bd9",
"space_group_name": "H 3",
"unit_cell": {
"a": 81.760,
"b": 81.760,
"c": 33.738,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [13.630,1.700],
"number_observations": 17037,
"number_observations_unique": 8205,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 11.700
},
{
"type": "Completeness",
"value": 93.100
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.971
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.700],
"number_observations": 666,
"number_observations_unique": 517,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.197
},
{
"type": "R(pim)",
"value": 0.197
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 1.300
},
{
"type": "CC(1/2)",
"value": 0.817
}
]
},
{
"resolution_limits": [13.630,8.830],
"number_observations": 88,
"number_observations_unique": 36,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.014
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 40.000
},
{
"type": "Completeness",
"value": 54.800
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}