Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7dd8dcc513512574b9467ed7202ee52e",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 86.817,
"b": 88.078,
"c": 166.367,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.25472],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.973,2.20],
"number_observations_unique": 65575,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "R(meas)",
"value": 0.124
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 14.5
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 12.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [46.93,10.08],
"number_observations_unique": 793,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "Redundancy",
"value": 12.1
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [2.25,2.20],
"number_observations_unique": 4574,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.992
},
{
"type": "R(meas)",
"value": 2.202
},
{
"type": "R(pim)",
"value": 0.930
},
{
"type": "Redundancy",
"value": 10.7
},
{
"type": "CC(1/2)",
"value": 0.465
}
]
}
]
}