Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "527439742e2882ac6f119ca1b3dbc61c",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 98.224,
"b": 82.377,
"c": 51.662,
"alpha": 90.00,
"beta": 114.84,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.88,1.32],
"number_observations_unique": 54908,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 14.9
},
{
"type": "Completeness",
"value": 82.8
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.45,1.32],
"number_observations_unique": 2513,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.985
},
{
"type": "R(pim)",
"value": 0.528
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 50.6
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.537
}
]
}
]
}