Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b87c8badad0ea7b3a8038fa26156cdfc",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.382,
"b": 85.450,
"c": 165.831,
"alpha": 90.00,
"beta": 96.17,
"gamma": 90.00
},
"wavelengths": [0.97872],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55,2.67],
"number_observations_unique": 30930,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "I/SigI",
"value": 12.95
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.77,2.67],
"number_observations_unique": 2898,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.643
},
{
"type": "I/SigI",
"value": 2.36
},
{
"type": "Completeness",
"value": 93.6
},
{
"type": "Redundancy",
"value": 4
},
{
"type": "CC(1/2)",
"value": 0.66
}
]
}
]
}