Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ec063c70939d1692e39b9bdf0aeaf612",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 89.618,
"b": 89.618,
"c": 106.406,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.96874],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.70,1.840],
"number_observations": 484521,
"number_observations_unique": 43422,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.498
},
{
"type": "R(meas)",
"value": 0.521
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "CC(1/2)",
"value": 0.936
}
]
},
"refln_shells": [
{
"resolution_limits": [1.87,1.84],
"number_observations": 21115,
"number_observations_unique": 2149,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.008
},
{
"type": "R(meas)",
"value": 4.21
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Completeness",
"value": 99.95
},
{
"type": "CC(1/2)",
"value": 0.264
}
]
},
{
"resolution_limits": [62.74,4.99],
"number_observations": 23472,
"number_observations_unique": 2338,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.333
},
{
"type": "R(meas)",
"value": 0.351
},
{
"type": "I/SigI",
"value": 18.6
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.816
}
]
}
]
}