Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "44db05eedc6eabb59722faca6ff1b963",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 49.119,
"b": 60.490,
"c": 80.803,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.119,1.69],
"number_observations_unique": 27259,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 21.62
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 7.13
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.79,1.69],
"number_observations_unique": 4134,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.423
},
{
"type": "I/SigI",
"value": 3.35
},
{
"type": "Completeness",
"value": 95.0
},
{
"type": "Redundancy",
"value": 7.32
},
{
"type": "CC(1/2)",
"value": 0.963
}
]
}
]
}