Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8956a68de3fd8dbca9fc8b97633a56b2",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 98.309,
"b": 82.011,
"c": 52.202,
"alpha": 90.00,
"beta": 115.61,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.201,1.785],
"number_observations_unique": 35216,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.919,1.785],
"number_observations_unique": 1382,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.193
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 48.7
},
{
"type": "CC(1/2)",
"value": 0.504
}
]
}
]
}