Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "739fcecc3d3ec707da8f1457845cd055",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 45.012,
"b": 54.909,
"c": 115.856,
"alpha": 90.00,
"beta": 101.17,
"gamma": 90.00
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.01,1.90],
"number_observations_unique": 21080,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 14.42
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations_unique": 2069,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.547
},
{
"type": "R(pim)",
"value": 0.337
},
{
"type": "I/SigI",
"value": 1.45
},
{
"type": "Completeness",
"value": 85.1
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.567
}
]
}
]
}