Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "af43cd24a2f9ca5fe2f3fa5b69d124e9",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 84.19,
"b": 84.19,
"c": 133.78,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.040,2.640],
"number_observations": 325398,
"number_observations_unique": 16668,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 20.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.710,2.640],
"number_observations": 24719,
"number_observations_unique": 1191,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.557
},
{
"type": "R(meas)",
"value": 1.596
},
{
"type": "R(pim)",
"value": 0.349
},
{
"type": "I/SigI",
"value": 2.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.800
},
{
"type": "CC(1/2)",
"value": 0.869
}
]
},
{
"resolution_limits": [38.040,11.810],
"number_observations": 2487,
"number_observations_unique": 214,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 43.300
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 11.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}