Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fa6cf69bf61d052615814b910e511279",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 64.599,
"b": 80.320,
"c": 76.579,
"alpha": 90.00,
"beta": 100.38,
"gamma": 90.00
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [80.32,1.65],
"number_observations_unique": 92484,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 8.2
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.65],
"number_observations_unique": 4543,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.296
},
{
"type": "R(meas)",
"value": 0.354
},
{
"type": "R(pim)",
"value": 0.191
},
{
"type": "I/SigI",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.872
}
]
}
]
}