Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d900bf2ea8d9c4ed5fba95b63495b030",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 103.36,
"b": 103.36,
"c": 61.96,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.760,2.290],
"number_observations": 369869,
"number_observations_unique": 17507,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "R(meas)",
"value": 0.150
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 16.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.370,2.290],
"number_observations_unique": 1708,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.99
},
{
"type": "R(meas)",
"value": 14.059
},
{
"type": "R(pim)",
"value": 3.045
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.100
},
{
"type": "CC(1/2)",
"value": 0.397
}
]
},
{
"resolution_limits": [44.760,8.870],
"number_observations_unique": 341,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.005
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 19.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}