Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "30b340bf3a4dc980992ff786961facda",
"space_group_name": "P 1",
"unit_cell": {
"a": 48.923,
"b": 59.630,
"c": 79.839,
"alpha": 79.67,
"beta": 82.01,
"gamma": 76.26
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.170,1.550],
"number_observations": 200660,
"number_observations_unique": 119114,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.590,1.550],
"number_observations": 12199,
"number_observations_unique": 8696,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.389
},
{
"type": "R(meas)",
"value": 0.550
},
{
"type": "R(pim)",
"value": 0.389
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 93.600
},
{
"type": "Redundancy",
"value": 1.400
},
{
"type": "CC(1/2)",
"value": 0.814
}
]
},
{
"resolution_limits": [78.170,6.930],
"number_observations": 2405,
"number_observations_unique": 1350,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 34.800
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}