Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "40c5b3c97d83006710af0d41490f6fc3",
"space_group_name": "I 21 21 21",
"unit_cell": {
"a": 99.745,
"b": 101.265,
"c": 160.856,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97628],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.228,1.529],
"number_observations_unique": 122425,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "R(meas)",
"value": 0.136
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.555,1.529],
"number_observations_unique": 6095,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.255
},
{
"type": "R(meas)",
"value": 1.429
},
{
"type": "R(pim)",
"value": 0.673
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.350
}
]
}
]
}