Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "912aa726b410e0445ee8a2e616248492",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 33.08,
"b": 61.62,
"c": 48.42,
"alpha": 90.00,
"beta": 90.23,
"gamma": 90.00
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.07,1.4],
"number_observations_unique": 34978,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 12.3
},
{
"type": "Completeness",
"value": 91.7
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.44,1.40],
"number_observations_unique": 1587,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.347
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 56.0
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.803
}
]
}
]
}