Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "269b730cf4712770e4a78d053c41fda3",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 67.623,
"b": 67.623,
"c": 164.729,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.730,1.650],
"number_observations": 960042,
"number_observations_unique": 27702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "R(meas)",
"value": 0.129
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 22.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 34.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 24321,
"number_observations_unique": 1290,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.351
},
{
"type": "R(meas)",
"value": 2.418
},
{
"type": "R(pim)",
"value": 0.539
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 18.900
},
{
"type": "CC(1/2)",
"value": 0.527
}
]
},
{
"resolution_limits": [47.730,9.040],
"number_observations": 6553,
"number_observations_unique": 239,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 49.800
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 27.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}