Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f9cc8cbe4ec5919d968e7d57a781448f",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.804,
"b": 88.804,
"c": 39.608,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.400,1.120],
"number_observations": 783147,
"number_observations_unique": 118321,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 12.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.140,1.120],
"number_observations": 37041,
"number_observations_unique": 5670,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.062
},
{
"type": "R(meas)",
"value": 3.325
},
{
"type": "R(pim)",
"value": 1.283
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.304
}
]
},
{
"resolution_limits": [44.400,6.130],
"number_observations": 5524,
"number_observations_unique": 794,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 51.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}