Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "318310a14da7569e51e5887b41931159",
"space_group_name": "P 1",
"unit_cell": {
"a": 36.334,
"b": 47.677,
"c": 51.720,
"alpha": 107.25,
"beta": 101.52,
"gamma": 111.78
},
"wavelengths": [0.98030],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.46,1.465],
"number_observations_unique": 47229,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "R(meas)",
"value": 0.130
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 6.9
},
{
"type": "Completeness",
"value": 95.2
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [1.491,1.465],
"number_observations_unique": 2307,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.444
},
{
"type": "R(meas)",
"value": 0.545
},
{
"type": "R(pim)",
"value": 0.308
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 92.4
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.792
}
]
}
]
}