Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4725c234cceb2b3a95ab75cbd9964331",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 92.923,
"b": 89.993,
"c": 93.865,
"alpha": 90.000,
"beta": 113.334,
"gamma": 90.000
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.61,2.7],
"number_observations_unique": 72486,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0622
},
{
"type": "R(pim)",
"value": 0.0396
},
{
"type": "I/SigI",
"value": 13.14
},
{
"type": "Completeness",
"value": 95.7
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.80,2.70],
"number_observations_unique": 3085,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.401
},
{
"type": "R(pim)",
"value": 0.280
},
{
"type": "I/SigI",
"value": 2.27
},
{
"type": "Completeness",
"value": 79.5
},
{
"type": "CC(1/2)",
"value": 0.918
}
]
}
]
}