Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3a39e6b9c7b05cbac35396d7737d3c9e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 57.077,
"b": 82.992,
"c": 64.501,
"alpha": 90.000,
"beta": 109.321,
"gamma": 90.000
},
"wavelengths": [1.10000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.22,2.17],
"number_observations_unique": 30086,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.17],
"number_observations_unique": 2603,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.482
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.765
}
]
}
]
}