Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f64fc7ea9a882f7e41b38a97e90cb22b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 112.844,
"b": 156.196,
"c": 151.600,
"alpha": 90.00,
"beta": 108.58,
"gamma": 90.00
},
"wavelengths": [0.97892],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,3.46],
"number_observations_unique": 65468,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 15.5
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [3.52,3.46],
"number_observations_unique": 3286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.952
},
{
"type": "R(meas)",
"value": 1.113
},
{
"type": "R(pim)",
"value": 0.567
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.138
}
]
}
]
}