Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d967be675b1632dd3d9d4ce140653daf",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 79.59,
"b": 97.75,
"c": 98.55,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91739],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.7950,1.550],
"number_observations_unique": 55915,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 19.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.590,1.550],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.798
},
{
"type": "I/SigI",
"value": 3.00
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.800
},
{
"type": "CC(1/2)",
"value": 0.914
}
]
},
{
"resolution_limits": [2.03,1.97],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.041
},
{
"type": "Completeness",
"value": 89.6
},
{
"type": "Redundancy",
"value": 12.3
},
{
"type": "CC(1/2)",
"value": 0.802
}
]
}
]
}