Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "78bf267c44d9335f11acda50e7900b80",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.467,
"b": 95.467,
"c": 45.932,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.390,1.320],
"number_observations": 557263,
"number_observations_unique": 47869,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 13.600
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 11.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.340,1.320],
"number_observations": 10592,
"number_observations_unique": 1981,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.727
},
{
"type": "R(meas)",
"value": 1.924
},
{
"type": "R(pim)",
"value": 0.811
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 83.400
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.333
}
]
},
{
"resolution_limits": [41.390,7.230],
"number_observations": 3984,
"number_observations_unique": 326,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 68.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.974
}
]
}
]
}