Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e79a1887a622f133781309cae2f5771f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.378,
"b": 41.599,
"c": 72.196,
"alpha": 90.00,
"beta": 104.21,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.6,1.21],
"number_observations_unique": 73224,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 15.6
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.23,1.21],
"number_observations_unique": 3370,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.704
},
{
"type": "R(pim)",
"value": 0.290
},
{
"type": "Completeness",
"value": 91.2
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.825
}
]
}
]
}