Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "67b4be90432d8fcb3e51b220b7d35e98",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 55.964,
"b": 42.843,
"c": 49.320,
"alpha": 90.00,
"beta": 92.78,
"gamma": 90.00
},
"wavelengths": [1.54178],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.95,1.85],
"number_observations_unique": 10076,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0651
},
{
"type": "R(meas)",
"value": 0.06736
},
{
"type": "R(pim)",
"value": 0.01717
},
{
"type": "I/SigI",
"value": 45.41
},
{
"type": "Completeness",
"value": 99.92
},
{
"type": "Redundancy",
"value": 15.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.916,1.85],
"number_observations_unique": 987,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "R(meas)",
"value": 0.1101
},
{
"type": "R(pim)",
"value": 0.02926
},
{
"type": "I/SigI",
"value": 28.57
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 14
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}