Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4a8b7df4ac865a5cfa99e54aaebc11c6",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 79.78,
"b": 122.95,
"c": 141.46,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97935],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.78,1.93],
"number_observations_unique": 103819,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 15.5
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.98,1.93],
"number_observations_unique": 7107,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.671
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Completeness",
"value": 92.8
},
{
"type": "Redundancy",
"value": 5.6
},
{
"type": "CC(1/2)",
"value": 0.854
}
]
}
]
}