Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "75516f31e19c5eee41a8a22d19ddf2af",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 87.310,
"b": 89.311,
"c": 155.634,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [77.82,2.35],
"number_observations_unique": 51484,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.282
},
{
"type": "R(meas)",
"value": 0.293
},
{
"type": "R(pim)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 6.2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.1
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.42,2.35],
"number_observations_unique": 4397,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.040
},
{
"type": "R(meas)",
"value": 1.088
},
{
"type": "R(pim)",
"value": 0.317
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.5
},
{
"type": "CC(1/2)",
"value": 0.895
}
]
}
]
}