Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "74cd79ab922c7fef2f45349a83b2e659",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.246,
"b": 59.826,
"c": 80.052,
"alpha": 79.42,
"beta": 81.55,
"gamma": 75.70
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.630,1.730],
"number_observations": 151077,
"number_observations_unique": 87066,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.770,1.730],
"number_observations": 9788,
"number_observations_unique": 6333,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.659
},
{
"type": "R(meas)",
"value": 0.932
},
{
"type": "R(pim)",
"value": 0.659
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 1.500
},
{
"type": "CC(1/2)",
"value": 0.461
}
]
},
{
"resolution_limits": [42.630,7.740],
"number_observations": 1833,
"number_observations_unique": 1000,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 26.100
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}