Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8976f484ff23e028905c117785bf73f2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.548,
"b": 127.805,
"c": 54.282,
"alpha": 90.00,
"beta": 95.19,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.6,1.93],
"number_observations_unique": 42961,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.98,1.93],
"number_observations_unique": 2808,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.635
},
{
"type": "R(pim)",
"value": 0.579
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "CC(1/2)",
"value": 0.865
}
]
}
]
}