Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f8980a85201c98416b5c69dd05d46bac",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.49,
"b": 60.02,
"c": 80.13,
"alpha": 79.15,
"beta": 81.35,
"gamma": 75.43
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.180,1.710],
"number_observations": 163557,
"number_observations_unique": 91119,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 5.600
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.710],
"number_observations": 11727,
"number_observations_unique": 6665,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.615
},
{
"type": "R(meas)",
"value": 0.869
},
{
"type": "R(pim)",
"value": 0.614
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.667
}
]
},
{
"resolution_limits": [50.180,7.650],
"number_observations": 1936,
"number_observations_unique": 1024,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.959
}
]
}
]
}