Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4274ad2592c69e98a5b1ad778b899766",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 36.25,
"b": 89.81,
"c": 44.27,
"alpha": 90.00,
"beta": 99.13,
"gamma": 90.00
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.25,1.21],
"number_observations_unique": 83274,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05076
},
{
"type": "R(pim)",
"value": 0.0208
},
{
"type": "I/SigI",
"value": 14.80
},
{
"type": "Completeness",
"value": 88.2
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.253,1.21],
"number_observations_unique": 8248,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.564
},
{
"type": "R(pim)",
"value": 0.6433
},
{
"type": "I/SigI",
"value": 1.34
},
{
"type": "Completeness",
"value": 72
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.669
}
]
}
]
}