Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a79aff35d0a7616fc77268b42027d6a5",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 39.093,
"b": 40.561,
"c": 84.650,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.58,1.35],
"number_observations_unique": 60134,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 37.83
},
{
"type": "Completeness",
"value": 99.66
},
{
"type": "Redundancy",
"value": 12.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.40,1.35],
"number_observations_unique": 5676,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.304
},
{
"type": "R(pim)",
"value": 0.151
},
{
"type": "I/SigI",
"value": 10.86
},
{
"type": "Completeness",
"value": 96.57
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}