Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "24868b4171a4d0ce92810b2c78ee4b3e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 115.743,
"b": 53.776,
"c": 45.409,
"alpha": 90.00,
"beta": 101.98,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.56,2.14],
"number_observations_unique": 14979,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.20,2.14],
"number_observations_unique": 1219,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.459
},
{
"type": "R(pim)",
"value": 0.722
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.388
}
]
}
]
}