Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a6532a96b174b00adac50c85340829ef",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.225,
"b": 51.390,
"c": 79.371,
"alpha": 90.00,
"beta": 91.98,
"gamma": 90.00
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.20,1.54],
"number_observations": 362830,
"number_observations_unique": 52060,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 15.6
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.57,1.54],
"number_observations": 17171,
"number_observations_unique": 2505,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.430
},
{
"type": "R(meas)",
"value": 0.465
},
{
"type": "R(pim)",
"value": 0.175
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.942
}
]
}
]
}