Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "194b0ae5f199870bdb7d7a18f7feb6a1",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.637,
"b": 59.950,
"c": 80.267,
"alpha": 79.09,
"beta": 81.28,
"gamma": 75.44
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.750,1.750],
"number_observations": 138886,
"number_observations_unique": 77189,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 6.200
},
{
"type": "Completeness",
"value": 87.300
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.840,1.750],
"number_observations": 22794,
"number_observations_unique": 12283,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.880
},
{
"type": "R(meas)",
"value": 1.245
},
{
"type": "R(pim)",
"value": 0.880
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.471
}
]
},
{
"resolution_limits": [47.750,5.530],
"number_observations": 4730,
"number_observations_unique": 2656,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 14.900
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}