Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bbc0a58c76e10b8a92e718a615d346ed",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 130.656,
"b": 149.948,
"c": 171.056,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.12710],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [75.087,2.83],
"number_observations_unique": 80491,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.149
},
{
"type": "R(pim)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 10.1
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [74.97,14.43],
"number_observations_unique": 705,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.972
}
]
},
{
"resolution_limits": [2.89,2.83],
"number_observations_unique": 4556,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.171
},
{
"type": "R(meas)",
"value": 1.383
},
{
"type": "R(pim)",
"value": 0.724
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.672
}
]
}
]
}