Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "10db9a39c8d789744b9420e58e17889b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.696,
"b": 74.289,
"c": 58.021,
"alpha": 90.0,
"beta": 115.8,
"gamma": 90.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.58,1.25],
"number_observations": 609044,
"number_observations_unique": 99570,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.096
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 15.0
},
{
"type": "Completeness",
"value": 93.3
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.28,1.25],
"number_observations": 11802,
"number_observations_unique": 4291,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.441
},
{
"type": "R(meas)",
"value": 0.539
},
{
"type": "R(pim)",
"value": 0.302
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.717
}
]
}
]
}