Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e1845cc2b30ec2f1a9a4f4910b6faa70",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 35.67,
"b": 47.34,
"c": 77.58,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97776],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.340,1.790],
"number_observations": 136769,
"number_observations_unique": 11567,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 21.200
},
{
"type": "Completeness",
"value": 89.000
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.830,1.790],
"number_observations": 8105,
"number_observations_unique": 746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.267
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 8.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.900
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
{
"resolution_limits": [47.340,8.950],
"number_observations": 1348,
"number_observations_unique": 136,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 28.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}