Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "9eb300cf86f00c0513e24e5827bb1e35",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.842,
"b": 88.842,
"c": 39.596,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.730,1.010],
"number_observations": 1083489,
"number_observations_unique": 160724,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 11.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.030,1.010],
"number_observations": 51663,
"number_observations_unique": 7708,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.957
},
{
"type": "R(meas)",
"value": 2.122
},
{
"type": "R(pim)",
"value": 0.810
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.491
}
]
},
{
"resolution_limits": [39.730,5.530],
"number_observations": 7112,
"number_observations_unique": 1048,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 35.300
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}