Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "221a95b183ce24e16b07ff7aaa7782bf",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 92.23,
"b": 137.45,
"c": 152.40,
"alpha": 90.00,
"beta": 90.12,
"gamma": 90.00
},
"wavelengths": [0.92820],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [68.5,2.6],
"number_observations_unique": 116521,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(pim)",
"value": 0.116
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.64,2.60],
"number_observations_unique": 5781,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.729
},
{
"type": "R(pim)",
"value": 0.668
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.281
}
]
}
]
}