Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "502586a69d6f1aea80cae271aa12b2bc",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 82.52,
"b": 82.52,
"c": 134.14,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.440,2.410],
"number_observations": 418585,
"number_observations_unique": 21041,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 27.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.470,2.410],
"number_observations": 32214,
"number_observations_unique": 1528,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.700
},
{
"type": "R(meas)",
"value": 1.742
},
{
"type": "R(pim)",
"value": 0.375
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.100
},
{
"type": "CC(1/2)",
"value": 0.815
}
]
},
{
"resolution_limits": [39.440,10.780],
"number_observations": 3619,
"number_observations_unique": 275,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 70.600
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 13.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}