Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f275ea114bc0d284197dcd6f6ab0b0ea",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 35.542,
"b": 73.663,
"c": 95.683,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.8310,1.550],
"number_observations_unique": 37064,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 11.800
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.580,1.550],
"number_observations_unique": 1762,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.457
},
{
"type": "R(meas)",
"value": 1.658
},
{
"type": "R(pim)",
"value": 0.776
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.505
}
]
},
{
"resolution_limits": [36.8310,8.490],
"number_observations_unique": 286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "R(meas)",
"value": 0.019
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}