Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "aea5a27f987b19eb50cea93f1e266b7a",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.063,
"b": 88.063,
"c": 39.245,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91188],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.070,1.010],
"number_observations": 749580,
"number_observations_unique": 151130,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 4.500
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.030,1.010],
"number_observations": 6825,
"number_observations_unique": 4847,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.575
},
{
"type": "R(meas)",
"value": 2.190
},
{
"type": "R(pim)",
"value": 1.517
},
{
"type": "I/SigI",
"value": 0.100
},
{
"type": "Completeness",
"value": 62.600
},
{
"type": "Redundancy",
"value": 1.400
},
{
"type": "CC(1/2)",
"value": 0.306
}
]
},
{
"resolution_limits": [88.070,5.530],
"number_observations": 7006,
"number_observations_unique": 1044,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 19.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}