Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1fe52ec918a65b7343bfe8f4ff48de1a",
"space_group_name": "P 65",
"unit_cell": {
"a": 104.44,
"b": 104.44,
"c": 139.19,
"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": 128973,
"number_observations_unique": 21250,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 22.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.970,2.800],
"number_observations": 21363,
"number_observations_unique": 3446,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.516
},
{
"type": "R(pim)",
"value": 0.226
},
{
"type": "I/SigI",
"value": 3.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.886
}
]
},
{
"resolution_limits": [69.600,8.400],
"number_observations": 4461,
"number_observations_unique": 798,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.020
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 55.400
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}