Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cace7daf056acfb2c3663d95a14d1bce",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.854,
"b": 52.595,
"c": 89.257,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.31,1.15],
"number_observations_unique": 71497,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 18.9
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [45.31,6.30],
"number_observations_unique": 521,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(meas)",
"value": 0.022
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [1.17,1.15],
"number_observations_unique": 3466,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.342
},
{
"type": "R(meas)",
"value": 1.562
},
{
"type": "R(pim)",
"value": 0.789
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.712
}
]
}
]
}