Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "99c236dfe8de6826fe5b69f18e7c689c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 108.517,
"b": 264.846,
"c": 109.153,
"alpha": 90.00,
"beta": 110.46,
"gamma": 90.00
},
"wavelengths": [0.97560],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.91,3.2],
"number_observations_unique": 93787,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 11.4
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 7.3
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.25,3.20],
"quality_factors": [
{
"type": "R(merge)",
"value": 2.470
},
{
"type": "R(pim)",
"value": 0.961
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.345
}
]
}
]
}