Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3dde5b8690ee7b25f2a31744f3cba4ad",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 130.60,
"b": 130.60,
"c": 114.59,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.96851],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.75,1.7],
"number_observations_unique": 63544,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.08164
},
{
"type": "R(pim)",
"value": 0.02249
},
{
"type": "I/SigI",
"value": 18.68
},
{
"type": "Completeness",
"value": 99.94
},
{
"type": "Redundancy",
"value": 13.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.7],
"number_observations_unique": 6247,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.063
},
{
"type": "R(pim)",
"value": 0.2857
},
{
"type": "I/SigI",
"value": 2.67
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 14
},
{
"type": "CC(1/2)",
"value": 0.826
}
]
}
]
}