Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "81b554fa2a2dec5fa4bb27be60f80a92",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 37.831,
"b": 66.305,
"c": 164.267,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.87,2.08],
"number_observations_unique": 25540,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.267
},
{
"type": "R(pim)",
"value": 0.114
},
{
"type": "I/SigI",
"value": 7.6
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [2.14,2.08],
"number_observations_unique": 1946,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.913
},
{
"type": "R(pim)",
"value": 0.837
},
{
"type": "CC(1/2)",
"value": 0.462
}
]
}
]
}