Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "809e200f35cbe8e9804021edce62c88e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 72.496,
"b": 79.579,
"c": 84.317,
"alpha": 90.00,
"beta": 101.78,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.240,2.650],
"number_observations_unique": 27106,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "R(meas)",
"value": 0.128
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.770,2.650],
"number_observations_unique": 3506,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.290
},
{
"type": "R(meas)",
"value": 2.687
},
{
"type": "R(pim)",
"value": 1.395
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.384
}
]
},
{
"resolution_limits": [60.240,8.780],
"number_observations_unique": 782,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}