Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b3b678e9f35f33df9915ca86822529af",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 80.649,
"b": 96.580,
"c": 57.914,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97940],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.290,1.780],
"number_observations": 183762,
"number_observations_unique": 21825,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 28.500
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 8.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.820,1.780],
"number_observations": 8257,
"number_observations_unique": 1105,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.548
},
{
"type": "R(pim)",
"value": 0.205
},
{
"type": "I/SigI",
"value": 3.600
},
{
"type": "Completeness",
"value": 90.400
},
{
"type": "Redundancy",
"value": 7.500
},
{
"type": "CC(1/2)",
"value": 0.961
}
]
},
{
"resolution_limits": [48.290,9.090],
"number_observations": 1583,
"number_observations_unique": 202,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 82.200
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 7.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}