Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "00c9fde7706811a95af1edf8db4e0e1c",
"space_group_name": "P 31",
"unit_cell": {
"a": 101.357,
"b": 101.357,
"c": 326.717,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [108.910,2.500],
"number_observations": 741038,
"number_observations_unique": 128287,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "R(meas)",
"value": 0.162
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 6.700
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.540,2.500],
"number_observations": 38530,
"number_observations_unique": 6440,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.766
},
{
"type": "R(meas)",
"value": 3.030
},
{
"type": "R(pim)",
"value": 1.231
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.732
}
]
},
{
"resolution_limits": [108.910,13.690],
"number_observations": 4315,
"number_observations_unique": 797,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 22.400
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}