Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "86573d417f05747fa9fbd8cb8f2aa3c5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 49.948,
"b": 59.220,
"c": 82.815,
"alpha": 90.00,
"beta": 104.43,
"gamma": 90.00
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.10,1.97],
"number_observations_unique": 16733,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.166
},
{
"type": "R(pim)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 8.1
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.01,1.97],
"number_observations_unique": 1156,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.005
},
{
"type": "R(meas)",
"value": 1.143
},
{
"type": "R(pim)",
"value": 0.537
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.4
}
]
}
]
}