Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dcf29d35143339aa205ca18a2fcf4b59",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 137.910,
"b": 29.780,
"c": 112.609,
"alpha": 90.00,
"beta": 124.91,
"gamma": 90.00
},
"wavelengths": [0.99900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.18,2.25],
"number_observations_unique": 18435,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(meas)",
"value": 0.108
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 8.7
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.32,2.25],
"number_observations_unique": 1686,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.358
},
{
"type": "R(meas)",
"value": 0.406
},
{
"type": "R(pim)",
"value": 0.188
},
{
"type": "I/SigI",
"value": 2.7
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.839
}
]
}
]
}