Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "24cbe4cafb5b716a9bd5378b223d9685",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.940,
"b": 171.326,
"c": 71.583,
"alpha": 90.00,
"beta": 100.28,
"gamma": 90.00
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.97,1.80],
"number_observations_unique": 82865,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.185
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.83,1.80],
"number_observations_unique": 4564,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.964
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.552
}
]
}
]
}