Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a9edfc5d8d6d4fdc124eeff046d83e86",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.454,
"b": 41.654,
"c": 72.045,
"alpha": 90.00,
"beta": 104.29,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.6,1.39],
"number_observations_unique": 47924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 18.1
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.39],
"number_observations_unique": 2295,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.757
},
{
"type": "R(pim)",
"value": 0.300
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 93.7
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.776
}
]
}
]
}