Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "6203670af857142cf9d08fe1fc9e142f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 95.552,
"b": 56.374,
"c": 72.612,
"alpha": 90.00,
"beta": 125.31,
"gamma": 90.00
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.40,1.44],
"number_observations_unique": 57031,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.46,1.44],
"number_observations_unique": 2748,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.198
},
{
"type": "R(pim)",
"value": 0.746
},
{
"type": "CC(1/2)",
"value": 0.320
}
]
}
]
}