Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "26904d202b84ec7dacbb5c21588abfc6",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 63.52,
"b": 107.27,
"c": 113.24,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.98,2.10],
"number_observations_unique": 45850,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.137
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 14.0
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 11.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.16,2.10],
"number_observations_unique": 3715,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.493
},
{
"type": "R(meas)",
"value": 2.719
},
{
"type": "R(pim)",
"value": 1.069
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 11.2
},
{
"type": "CC(1/2)",
"value": 0.565
}
]
}
]
}