Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "63ad074dfa6241f16256a09b7653561a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 80.360,
"b": 70.840,
"c": 134.219,
"alpha": 90.00,
"beta": 98.69,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.2,2.70],
"number_observations_unique": 41272,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.85,2.70],
"number_observations_unique": 5955,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.858
},
{
"type": "R(pim)",
"value": 0.371
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.907
}
]
}
]
}