Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "618095cfc2e9270da5112d99a450157b",
"space_group_name": "P 1",
"unit_cell": {
"a": 60.887,
"b": 62.407,
"c": 71.415,
"alpha": 69.24,
"beta": 82.88,
"gamma": 62.19
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.01,1.550],
"number_observations_unique": 120656,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 7.700
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.550],
"number_observations": 46384,
"number_observations_unique": 17393,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.340
},
{
"type": "R(meas)",
"value": 0.423
},
{
"type": "R(pim)",
"value": 0.248
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.905
}
]
},
{
"resolution_limits": [51.950,4.900],
"number_observations": 9187,
"number_observations_unique": 3805,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}