Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "766c244b5564100408f38e81d02cd4d1",
"space_group_name": "H 3",
"unit_cell": {
"a": 126.659,
"b": 126.659,
"c": 63.271,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.442,1.750],
"number_observations": 209970,
"number_observations_unique": 37974,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.780,1.750],
"number_observations": 11990,
"number_observations_unique": 2114,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.039
},
{
"type": "R(pim)",
"value": 0.481
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.665
}
]
},
{
"resolution_limits": [41.440,9.090],
"number_observations": 1320,
"number_observations_unique": 260,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 37.900
},
{
"type": "Completeness",
"value": 94.300
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
}
]
}