Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "9a5ca93d7fa8c75bae5bc373ee61d37b",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 82.75,
"b": 82.75,
"c": 134.74,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.550,2.400],
"number_observations": 426561,
"number_observations_unique": 21498,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 19.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.460,2.400],
"number_observations": 33190,
"number_observations_unique": 1569,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.272
},
{
"type": "R(meas)",
"value": 2.328
},
{
"type": "R(pim)",
"value": 0.505
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.200
},
{
"type": "CC(1/2)",
"value": 0.764
}
]
},
{
"resolution_limits": [39.550,10.730],
"number_observations": 3713,
"number_observations_unique": 285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 50.700
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 13.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}