Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9152d399fdf4ab20c4e068bbcd9aaa12",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.239,
"b": 88.239,
"c": 39.068,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91258],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.250,1.050],
"number_observations": 724481,
"number_observations_unique": 139326,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 4.800
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.070,1.050],
"number_observations": 12782,
"number_observations_unique": 5814,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.064
},
{
"type": "R(meas)",
"value": 2.633
},
{
"type": "R(pim)",
"value": 1.604
},
{
"type": "I/SigI",
"value": 0.200
},
{
"type": "Completeness",
"value": 84.600
},
{
"type": "Redundancy",
"value": 2.200
},
{
"type": "CC(1/2)",
"value": 0.267
}
]
},
{
"resolution_limits": [88.250,5.750],
"number_observations": 6349,
"number_observations_unique": 939,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 18.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}