Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ad1a849b918a2fc8c9ab8f41c8487bf",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 38.58,
"b": 77.01,
"c": 99.88,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.900,1.630],
"number_observations": 237678,
"number_observations_unique": 38029,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 11.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.670,1.630],
"number_observations": 14702,
"number_observations_unique": 2788,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.257
},
{
"type": "R(meas)",
"value": 1.398
},
{
"type": "R(pim)",
"value": 0.600
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.521
}
]
},
{
"resolution_limits": [41.900,7.290],
"number_observations": 2835,
"number_observations_unique": 508,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 31.500
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}