Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4897c2697ff5c31f71d178b90d24fa4d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.593,
"b": 41.649,
"c": 72.315,
"alpha": 90.000,
"beta": 104.583,
"gamma": 90.000
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.65,1.48],
"number_observations_unique": 40433,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 10.1
},
{
"type": "Completeness",
"value": 97.7
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.50,1.48],
"number_observations_unique": 1407,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.790
},
{
"type": "R(pim)",
"value": 0.370
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 69.4
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.625
}
]
}
]
}