Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a034ee7d316682b9eca8c1201c30b347",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.22,
"b": 52.05,
"c": 48.72,
"alpha": 90.00,
"beta": 108.17,
"gamma": 90.00
},
"wavelengths": [1.11580],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.05,1.995],
"number_observations_unique": 13454,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.199
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Completeness",
"value": 93.5
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.974
}
]
},
"refln_shells": [
{
"resolution_limits": [2.05,1.995],
"number_observations_unique": 942,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.779
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 88.8
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.508
}
]
}
]
}