Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "dee0810cec338a4f1fa52a5b46f90ada",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.822,
"b": 88.822,
"c": 39.614,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.410,1.000],
"number_observations": 1044060,
"number_observations_unique": 165992,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "R(meas)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 7.900
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.020,1.000],
"number_observations": 35565,
"number_observations_unique": 7553,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.998
},
{
"type": "R(meas)",
"value": 2.245
},
{
"type": "R(pim)",
"value": 1.001
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 91.800
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.359
}
]
},
{
"resolution_limits": [44.410,5.480],
"number_observations": 7622,
"number_observations_unique": 1101,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 27.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}