Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5154740fc79d4f27985477de60e4ee01",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 143.217,
"b": 43.478,
"c": 82.383,
"alpha": 90.00,
"beta": 99.22,
"gamma": 90.00
},
"wavelengths": [0.96862],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.500,2.650],
"number_observations": 36238,
"number_observations_unique": 13189,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "R(meas)",
"value": 0.187
},
{
"type": "R(pim)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 6.600
},
{
"type": "Completeness",
"value": 88.800
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [2.780,2.650],
"number_observations_unique": 1812,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.893
},
{
"type": "R(meas)",
"value": 1.073
},
{
"type": "R(pim)",
"value": 0.582
},
{
"type": "Completeness",
"value": 92.000
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.588
}
]
},
{
"resolution_limits": [34.500,8.790],
"number_observations_unique": 352,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "Completeness",
"value": 79.500
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}