Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "11d96a0428a2d70b39993de1cce7a81c",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 93.510,
"b": 93.510,
"c": 204.136,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [75.280,3.060],
"number_observations_unique": 20270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 20.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 18.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [3.220,3.060],
"number_observations_unique": 2911,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.693
},
{
"type": "R(meas)",
"value": 1.736
},
{
"type": "R(pim)",
"value": 0.378
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.700
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
},
{
"resolution_limits": [75.280,9.660],
"number_observations_unique": 738,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 15.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}