Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3ef61197e64f69872dad2d5a5146dae8",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 46.32,
"b": 21.80,
"c": 83.83,
"alpha": 90.00,
"beta": 104.24,
"gamma": 90.00
},
"wavelengths": [0.96859],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.63,1.407],
"number_observations_unique": 15424,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 12.2
},
{
"type": "Completeness",
"value": 95.9
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.43,1.41],
"number_observations_unique": 772,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.819
},
{
"type": "R(pim)",
"value": 0.359
},
{
"type": "I/SigI",
"value": 4.0
},
{
"type": "Completeness",
"value": 97.0
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.843
}
]
}
]
}