Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "ce4555d8b6155d311840d9a23512ed46",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 48.208,
"b": 65.869,
"c": 123.389,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97740],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [61.69,1.729],
"number_observations_unique": 14265,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 16.6
},
{
"type": "Completeness",
"value": 91.5
},
{
"type": "Redundancy",
"value": 12.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.977,1.729],
"number_observations_unique": 1426,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.999
},
{
"type": "R(meas)",
"value": 1.080
},
{
"type": "R(pim)",
"value": 0.395
},
{
"type": "I/SigI",
"value": 41.9
},
{
"type": "Completeness",
"value": 62.4
},
{
"type": "Redundancy",
"value": 7.3
},
{
"type": "CC(1/2)",
"value": 0.701
}
]
},
{
"resolution_limits": [61.694,4.349],
"number_observations_unique": 1427,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 12.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}