Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "117fffcbd2500aaea8c3671749a3a9a0",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 83.501,
"b": 81.773,
"c": 91.726,
"alpha": 90.00,
"beta": 99.57,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.43,1.598],
"number_observations_unique": 79229,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 16.3
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.60],
"number_observations": 24552,
"number_observations_unique": 3819,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.114
},
{
"type": "R(meas)",
"value": 1.210
},
{
"type": "R(pim)",
"value": 0.468
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.709
}
]
}
]
}