Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0e9f1df7e86e88fab24edd8271fe3bfb",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.679,
"b": 71.679,
"c": 150.920,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.500,1.530],
"number_observations": 768467,
"number_observations_unique": 59714,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 32.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.560,1.530],
"number_observations": 33305,
"number_observations_unique": 2959,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.959
},
{
"type": "R(meas)",
"value": 1.004
},
{
"type": "R(pim)",
"value": 0.291
},
{
"type": "I/SigI",
"value": 2.900
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 11.300
},
{
"type": "CC(1/2)",
"value": 0.804
}
]
},
{
"resolution_limits": [29.500,8.260],
"number_observations": 5325,
"number_observations_unique": 473,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 125.000
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 11.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}