Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fe9a073653767fff49c72fbb53aecbc4",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 46.725,
"b": 79.613,
"c": 104.775,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97934],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.11,1.38],
"number_observations_unique": 80218,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 18.6
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 12.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.41,1.38],
"number_observations_unique": 3732,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.763
},
{
"type": "R(meas)",
"value": 0.818
},
{
"type": "R(pim)",
"value": 0.288
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.805
}
]
}
]
}