Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "463fa2576a0c798031b1a693d80509b5",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 83.03,
"b": 83.03,
"c": 133.24,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.710,2.180],
"number_observations": 564668,
"number_observations_unique": 28370,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "R(meas)",
"value": 0.136
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 19.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.180],
"number_observations": 38816,
"number_observations_unique": 2039,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.217
},
{
"type": "R(meas)",
"value": 2.278
},
{
"type": "R(pim)",
"value": 0.519
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.000
},
{
"type": "CC(1/2)",
"value": 0.677
}
]
},
{
"resolution_limits": [34.710,9.750],
"number_observations": 4875,
"number_observations_unique": 367,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 55.500
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 13.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}