Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "364839d230daa6f3778ae0c5ab737cdf",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.422,
"b": 95.422,
"c": 45.916,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.370,1.330],
"number_observations": 552340,
"number_observations_unique": 46750,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 15.400
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.350,1.330],
"number_observations": 11436,
"number_observations_unique": 1971,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.620
},
{
"type": "R(meas)",
"value": 1.780
},
{
"type": "R(pim)",
"value": 0.710
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 84.200
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.356
}
]
},
{
"resolution_limits": [41.370,7.280],
"number_observations": 3855,
"number_observations_unique": 316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 84.900
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}