Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1ae5b7e8d6eb32cbb28e57eb6b079aba",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 38.63,
"b": 77.06,
"c": 99.45,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.910,1.640],
"number_observations": 232158,
"number_observations_unique": 37239,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 11.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.640],
"number_observations": 14493,
"number_observations_unique": 2727,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.350
},
{
"type": "R(meas)",
"value": 1.501
},
{
"type": "R(pim)",
"value": 0.644
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.514
}
]
},
{
"resolution_limits": [60.910,7.330],
"number_observations": 2727,
"number_observations_unique": 501,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 33.800
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}