Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a3320ee1294cf8df4b66f972a01f32fb",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 65.041,
"b": 152.300,
"c": 88.636,
"alpha": 90.00,
"beta": 102.43,
"gamma": 90.00
},
"wavelengths": [0.97872],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.00,2.20],
"number_observations_unique": 86948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 23.8
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 4.5
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.20],
"number_observations_unique": 4317,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.805
},
{
"type": "R(meas)",
"value": 0.915
},
{
"type": "R(pim)",
"value": 0.431
},
{
"type": "I/SigI",
"value": 1.94
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.779
}
]
}
]
}