Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "668b9d8b49c0cab83b2a4f15d13716b9",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.147,
"b": 60.656,
"c": 32.202,
"alpha": 90.00,
"beta": 92.71,
"gamma": 90.00
},
"wavelengths": [0.94054],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.03,2.75],
"number_observations": 16659,
"number_observations_unique": 3481,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.296
},
{
"type": "R(meas)",
"value": 0.335
},
{
"type": "R(pim)",
"value": 0.155
},
{
"type": "I/SigI",
"value": 3.9
},
{
"type": "Completeness",
"value": 94.5
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.933
}
]
},
"refln_shells": [
{
"resolution_limits": [2.89,2.75],
"number_observations": 2587,
"number_observations_unique": 534,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.952
},
{
"type": "R(meas)",
"value": 1.086
},
{
"type": "R(pim)",
"value": 0.513
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.469
}
]
}
]
}