Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "26d1a7e754f414de2a2d477d654de88d",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 80.55,
"b": 80.55,
"c": 139.36,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.380,1.840],
"number_observations": 450303,
"number_observations_unique": 23971,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 14.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.890,1.840],
"number_observations": 33288,
"number_observations_unique": 1728,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.024
},
{
"type": "R(meas)",
"value": 2.079
},
{
"type": "R(pim)",
"value": 0.471
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 0.550
}
]
},
{
"resolution_limits": [62.380,8.230],
"number_observations": 5659,
"number_observations_unique": 346,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 55.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 16.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}