Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "66221b8c9f84d5b2d2af6ac4214a1016",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 55.374,
"b": 77.236,
"c": 107.601,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97894],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.28],
"number_observations_unique": 21775,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 26.6
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 10.8
},
{
"type": "CC(1/2)",
"value": 0.915
}
]
},
"refln_shells": [
{
"resolution_limits": [2.32,2.28],
"number_observations_unique": 1073,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.071
},
{
"type": "R(meas)",
"value": 1.124
},
{
"type": "R(pim)",
"value": 0.335
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 10.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}