Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9918804989ea7637fd48c542f777d241",
"space_group_name": "P 1",
"unit_cell": {
"a": 38.587,
"b": 52.167,
"c": 55.579,
"alpha": 92.113,
"beta": 105.123,
"gamma": 111.513
},
"wavelengths": [0.96900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.07,1.80],
"number_observations_unique": 34852,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 11.9
},
{
"type": "Completeness",
"value": 97.7
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [53.07,9.00],
"number_observations_unique": 287,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [1.84,1.80],
"number_observations_unique": 2038,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.478
},
{
"type": "R(meas)",
"value": 0.560
},
{
"type": "R(pim)",
"value": 0.289
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.891
}
]
}
]
}