Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "91ba928e5abe1fe9fcec018fd72dcd0f",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.692,
"b": 88.692,
"c": 39.693,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.350,0.930],
"number_observations": 1351495,
"number_observations_unique": 205292,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 19.100
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [0.950,0.930],
"number_observations": 41385,
"number_observations_unique": 9299,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.090
},
{
"type": "R(meas)",
"value": 1.238
},
{
"type": "R(pim)",
"value": 0.572
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 90.600
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.584
}
]
},
{
"resolution_limits": [44.350,5.090],
"number_observations": 8817,
"number_observations_unique": 1335,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 58.700
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
}
]
}