Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b35ee018c8205da3bfab471972258024",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.45,
"b": 59.88,
"c": 79.89,
"alpha": 79.29,
"beta": 81.26,
"gamma": 75.44
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.590,1.770],
"number_observations": 142252,
"number_observations_unique": 80967,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [1.820,1.770],
"number_observations": 10038,
"number_observations_unique": 5843,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.716
},
{
"type": "R(meas)",
"value": 1.012
},
{
"type": "R(pim)",
"value": 0.716
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 93.600
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.589
}
]
},
{
"resolution_limits": [41.590,7.920],
"number_observations": 1762,
"number_observations_unique": 924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 19.300
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
}
]
}