Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7b53a15edca55e756b6678f22bd4a9a2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 35.247,
"b": 98.599,
"c": 50.655,
"alpha": 90.000,
"beta": 108.184,
"gamma": 90.000
},
"wavelengths": [0.99980],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,2.17],
"number_observations_unique": 17092,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 15.7
},
{
"type": "Completeness",
"value": 98.3
},
{
"type": "Redundancy",
"value": 3.5
}
]
},
"refln_shells": [
{
"resolution_limits": [2.25,2.17],
"number_observations_unique": 1680,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.320
},
{
"type": "R(pim)",
"value": 0.215
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Completeness",
"value": 96.9
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.859
}
]
}
]
}