Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b90867fe5a2052b86362f422e79bc1f0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 63.301,
"b": 176.778,
"c": 100.019,
"alpha": 90.0,
"beta": 96.1,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.65],
"number_observations_unique": 60192,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "R(pim)",
"value": 0.096
},
{
"type": "I/SigI",
"value": 16.5
},
{
"type": "Completeness",
"value": 94.7
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.948
}
]
},
"refln_shells": [
{
"resolution_limits": [2.7,2.65],
"number_observations_unique": 2536,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.505
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 80.8
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.517
}
]
}
]
}