Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4e5a4b87c6524ec5e50da0e99b0277ac",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 52.535,
"b": 81.696,
"c": 91.586,
"alpha": 90.00,
"beta": 95.32,
"gamma": 90.00
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.85,1.85],
"number_observations_unique": 32349,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 24.07
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.92,1.85],
"number_observations_unique": 3156,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.416
},
{
"type": "R(pim)",
"value": 0.252
},
{
"type": "I/SigI",
"value": 2.36
},
{
"type": "Completeness",
"value": 95.8
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.818
}
]
}
]
}