Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ff68a2851ee89002d0f7f45b9059c08c",
"space_group_name": "P 1",
"unit_cell": {
"a": 32.22,
"b": 36.13,
"c": 75.49,
"alpha": 100.54,
"beta": 95.55,
"gamma": 90.01
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.860,2.300],
"number_observations_unique": 12858,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 2.900
},
{
"type": "Completeness",
"value": 86.800
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.380,2.300],
"number_observations_unique": 1296,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.394
},
{
"type": "R(meas)",
"value": 0.557
},
{
"type": "R(pim)",
"value": 0.394
},
{
"type": "Completeness",
"value": 91.600
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.719
}
]
},
{
"resolution_limits": [73.860,8.910],
"number_observations_unique": 221,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "Completeness",
"value": 86.300
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}