Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dd781ccd2197bda7e8b022c65dbc2dfd",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 78.890,
"b": 89.550,
"c": 99.769,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.700,2.600],
"number_observations_unique": 22383,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.300
},
{
"type": "I/SigI",
"value": 9.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 14.100
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.720,2.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.613
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.400
}
]
},
{
"resolution_limits": [26.700,9.010],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 11.900
}
]
}
]
}