Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bd705998e724202b82c44705d26b907d",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 74.413,
"b": 74.413,
"c": 174.612,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.190,1.650],
"number_observations": 334111,
"number_observations_unique": 65550,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 19.800
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 8702,
"number_observations_unique": 2524,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.384
},
{
"type": "R(pim)",
"value": 0.211
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 76.500
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.873
}
]
},
{
"resolution_limits": [43.190,9.040],
"number_observations": 2430,
"number_observations_unique": 494,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.020
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 49.200
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}