Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5dd58f624876a244a9bd1ff5a42f244d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 33.45,
"b": 58.59,
"c": 78.57,
"alpha": 90.00,
"beta": 100.64,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.680,2.150],
"number_observations": 59944,
"number_observations_unique": 16295,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "R(pim)",
"value": 0.111
},
{
"type": "I/SigI",
"value": 7.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [2.410,2.150],
"number_observations": 16998,
"number_observations_unique": 4613,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.616
},
{
"type": "R(pim)",
"value": 0.372
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.679
}
]
},
{
"resolution_limits": [46.680,4.820],
"number_observations": 5327,
"number_observations_unique": 1498,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 18.400
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}