Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0190e92633230f395d57b416d3e50f81",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.535,
"b": 59.991,
"c": 80.050,
"alpha": 79.16,
"beta": 81.16,
"gamma": 75.31
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.910,1.570],
"number_observations": 201268,
"number_observations_unique": 115029,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 10.000
},
{
"type": "Completeness",
"value": 94.700
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.660,1.570],
"number_observations": 25283,
"number_observations_unique": 16672,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.945
},
{
"type": "R(meas)",
"value": 1.336
},
{
"type": "R(pim)",
"value": 0.944
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 94.000
},
{
"type": "Redundancy",
"value": 1.500
},
{
"type": "CC(1/2)",
"value": 0.515
}
]
},
{
"resolution_limits": [34.910,4.970],
"number_observations": 6551,
"number_observations_unique": 3639,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 29.300
},
{
"type": "Completeness",
"value": 94.700
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}