Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "229ab9c6eacd4010703898bd0c4f15cf",
"space_group_name": "P 65",
"unit_cell": {
"a": 104.40,
"b": 104.40,
"c": 139.16,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.93220],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.600,2.800],
"number_observations": 128743,
"number_observations_unique": 21198,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 22.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.950,2.800],
"number_observations": 19229,
"number_observations_unique": 3100,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.450
},
{
"type": "R(pim)",
"value": 0.197
},
{
"type": "I/SigI",
"value": 4.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.912
}
]
},
{
"resolution_limits": [69.600,8.850],
"number_observations": 3709,
"number_observations_unique": 676,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 51.400
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
}
]
}