Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ae295657047649d86f97ea96617a479f",
"space_group_name": "P 1",
"unit_cell": {
"a": 96.043,
"b": 96.113,
"c": 97.673,
"alpha": 76.40,
"beta": 80.72,
"gamma": 63.19
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.79,2.91],
"number_observations_unique": 31781,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 6.5
},
{
"type": "Completeness",
"value": 71.1
},
{
"type": "Redundancy",
"value": 2
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [3.13,2.91],
"number_observations_unique": 1590,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.492
},
{
"type": "R(pim)",
"value": 0.469
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.385
}
]
}
]
}