Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "cf2aeac04af7fa3ac03ef9f88a60fc33",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 82.32,
"b": 82.32,
"c": 134.28,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.090,2.470],
"number_observations": 376554,
"number_observations_unique": 19484,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
},
{
"type": "R(meas)",
"value": 0.183
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 13.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.530,2.470],
"number_observations": 28802,
"number_observations_unique": 1418,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.227
},
{
"type": "R(meas)",
"value": 2.284
},
{
"type": "R(pim)",
"value": 0.506
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.300
},
{
"type": "CC(1/2)",
"value": 0.651
}
]
},
{
"resolution_limits": [35.090,11.050],
"number_observations": 3279,
"number_observations_unique": 255,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 30.900
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}