Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7b77916cbcf6b1038f56a14904df9d13",
"space_group_name": "P 1",
"unit_cell": {
"a": 57.481,
"b": 94.711,
"c": 97.398,
"alpha": 70.38,
"beta": 77.46,
"gamma": 79.14
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.46,2.09],
"number_observations_unique": 108372,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 25.75
},
{
"type": "Completeness",
"value": 97.2
},
{
"type": "Redundancy",
"value": 12.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.12,2.09],
"number_observations_unique": 13035,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.281
},
{
"type": "R(pim)",
"value": 0.912
},
{
"type": "CC(1/2)",
"value": 0.474
}
]
}
]
}