Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "cf7cdb8b69fcf5b4724ccf1fb68182a2",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.770,
"b": 88.770,
"c": 39.477,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.380,1.000],
"number_observations": 1046168,
"number_observations_unique": 165442,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.020,1.000],
"number_observations": 36641,
"number_observations_unique": 7676,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.221
},
{
"type": "R(meas)",
"value": 1.368
},
{
"type": "R(pim)",
"value": 0.604
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 93.900
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.657
}
]
},
{
"resolution_limits": [44.380,5.480],
"number_observations": 7457,
"number_observations_unique": 1093,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 55.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}