Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80d13575a13119ad81dbeb5f756ebce2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.295,
"b": 45.809,
"c": 63.064,
"alpha": 90.00,
"beta": 111.39,
"gamma": 90.00
},
"wavelengths": [0.91590],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.96,1.39],
"number_observations": 275869,
"number_observations_unique": 62446,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 9.6
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.46,1.39],
"number_observations": 39546,
"number_observations_unique": 9036,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.022
},
{
"type": "R(meas)",
"value": 2.298
},
{
"type": "R(pim)",
"value": 1.075
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.371
}
]
}
]
}