Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5a5d3f3c7f1e4880761ccd282465b46c",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 202.485,
"b": 202.485,
"c": 104.271,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.852,3.2],
"number_observations_unique": 13135,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.535
},
{
"type": "R(meas)",
"value": 0.589
},
{
"type": "R(pim)",
"value": 0.244
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 0.974
}
]
},
"refln_shells": [
{
"resolution_limits": [3.42,3.20],
"number_observations_unique": 2447,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.093
},
{
"type": "R(meas)",
"value": 4.503
},
{
"type": "R(pim)",
"value": 1.862
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 0.323
}
]
},
{
"resolution_limits": [44.79,9.05],
"number_observations_unique": 637,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 10.2
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}