Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c84bc9c53c5dddcba4907dc7b8ec285b",
"space_group_name": "P 63 2 2",
"unit_cell": {
"a": 115.395,
"b": 115.395,
"c": 58.784,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [57.700,1.800],
"number_observations": 555856,
"number_observations_unique": 21898,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 15.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.850,1.800],
"number_observations": 37780,
"number_observations_unique": 1573,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.302
},
{
"type": "R(meas)",
"value": 4.394
},
{
"type": "R(pim)",
"value": 0.885
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 24.000
},
{
"type": "CC(1/2)",
"value": 0.843
}
]
},
{
"resolution_limits": [57.700,8.050],
"number_observations": 6761,
"number_observations_unique": 313,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 48.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 21.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}