Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "694f08f3d677653df765c06c2a4d7c73",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 40.918,
"b": 78.262,
"c": 80.604,
"alpha": 90.00,
"beta": 90.24,
"gamma": 90.00
},
"wavelengths": [1.09720],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.92,1.39],
"number_observations": 1820506,
"number_observations_unique": 93127,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 29.6
},
{
"type": "Completeness",
"value": 91.5
},
{
"type": "Redundancy",
"value": 19.5
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.41,1.39],
"number_observations": 34536,
"number_observations_unique": 2681,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.347
},
{
"type": "R(meas)",
"value": 5.566
},
{
"type": "R(pim)",
"value": 1.510
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 12.9
},
{
"type": "CC(1/2)",
"value": 0.355
}
]
}
]
}