Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d3918fa59b729129cc25d08a429175ea",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.063,
"b": 52.781,
"c": 45.874,
"alpha": 90.00,
"beta": 102.56,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.56,1.73],
"number_observations_unique": 27609,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.73],
"number_observations_unique": 1513,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.211
},
{
"type": "R(pim)",
"value": 0.692
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 4
},
{
"type": "CC(1/2)",
"value": 0.371
}
]
}
]
}