Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "13d3e35e67642d177bbf4d24c49e972c",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.667,
"b": 53.843,
"c": 45.115,
"alpha": 90.000,
"beta": 101.857,
"gamma": 90.000
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.110,2.491],
"number_observations_unique": 5686,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.19
},
{
"type": "R(meas)",
"value": 0.221
},
{
"type": "I/SigI",
"value": 3.712
},
{
"type": "Completeness",
"value": 86.23
},
{
"type": "Redundancy",
"value": 3.75
},
{
"type": "CC(1/2)",
"value": 0.9850
}
]
},
"refln_shells": [
{
"resolution_limits": [2.815,2.491],
"number_observations_unique": 285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.922
},
{
"type": "I/SigI",
"value": 1.076
},
{
"type": "Completeness",
"value": 48.55
},
{
"type": "Redundancy",
"value": 3.69
},
{
"type": "CC(1/2)",
"value": 0.5782
}
]
}
]
}