Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7eb660b7b86e9fbc83e696125c763051",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 49.638,
"b": 80.673,
"c": 136.342,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.52,1.91],
"number_observations": 582810,
"number_observations_unique": 43157,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.151
},
{
"type": "R(meas)",
"value": 0.157
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.02,1.91],
"number_observations_unique": 6190,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.75
},
{
"type": "R(meas)",
"value": 0.9
},
{
"type": "R(pim)",
"value": 0.9
},
{
"type": "Redundancy",
"value": 13.1
},
{
"type": "CC(1/2)",
"value": 0.391
}
]
}
]
}