Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "847a41dbec4641739c46091837b44965",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 80.200,
"b": 71.873,
"c": 90.531,
"alpha": 90.000,
"beta": 113.813,
"gamma": 90.000
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.94,1.85],
"number_observations_unique": 78980,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 39.3
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.88,1.85],
"number_observations_unique": 3939,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.712
},
{
"type": "R(pim)",
"value": 0.290
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.879
}
]
}
]
}