Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "605238977bdd8e123f7c82b410538023",
"space_group_name": "P 1",
"unit_cell": {
"a": 61.24,
"b": 67.84,
"c": 77.86,
"alpha": 109.76,
"beta": 92.36,
"gamma": 115.30
},
"wavelengths": [0.97880],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.750,1.500],
"number_observations": 1150437,
"number_observations_unique": 159668,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.580,1.500],
"number_observations_unique": 22902,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.525
},
{
"type": "R(meas)",
"value": 0.601
},
{
"type": "R(pim)",
"value": 0.291
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.893
}
]
},
{
"resolution_limits": [35.750,4.750],
"number_observations_unique": 4990,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}