Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "244c021b7bbda0a1924ce7b645e4eb89",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 160.922,
"b": 160.922,
"c": 122.960,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.880,3.050],
"number_observations": 740378,
"number_observations_unique": 31341,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.374
},
{
"type": "R(meas)",
"value": 0.382
},
{
"type": "R(pim)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 23.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.210,3.050],
"number_observations": 105244,
"number_observations_unique": 4504,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.904
},
{
"type": "R(meas)",
"value": 2.967
},
{
"type": "R(pim)",
"value": 0.609
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 23.400
},
{
"type": "CC(1/2)",
"value": 0.629
}
]
},
{
"resolution_limits": [29.880,9.640],
"number_observations": 24703,
"number_observations_unique": 1080,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 33.800
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 22.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}