Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6897f2f76df88e452daa6bf61a59aad2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 29.37,
"b": 65.63,
"c": 44.61,
"alpha": 90.000,
"beta": 95.738,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.81,1.66],
"number_observations_unique": 19751,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1385
},
{
"type": "R(meas)",
"value": 0.1501
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 7.77
},
{
"type": "Completeness",
"value": 98.89
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.72,1.66],
"number_observations_unique": 1947,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.77
},
{
"type": "R(meas)",
"value": 2.99
},
{
"type": "R(pim)",
"value": 1.114
},
{
"type": "I/SigI",
"value": 0.96
},
{
"type": "Completeness",
"value": 97.45
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.339
}
]
}
]
}