Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ae3801cfa2c1ad7c4802677058a26fb6",
"space_group_name": "P 32",
"unit_cell": {
"a": 82.64,
"b": 82.64,
"c": 169.60,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.940,3.000],
"number_observations": 258669,
"number_observations_unique": 25970,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.231
},
{
"type": "R(meas)",
"value": 0.244
},
{
"type": "R(pim)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.000
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [3.180,3.000],
"number_observations": 43295,
"number_observations_unique": 4234,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.966
},
{
"type": "R(meas)",
"value": 1.018
},
{
"type": "R(pim)",
"value": 0.320
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.713
}
]
},
{
"resolution_limits": [65.940,9.000],
"number_observations": 9291,
"number_observations_unique": 960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.103
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 15.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 9.700
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}