Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e095c24982f6a3d2cfee8350a149c508",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.19,
"b": 37.20,
"c": 81.99,
"alpha": 90.00,
"beta": 99.45,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.796,2.499],
"number_observations_unique": 8962,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(meas)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 91.6
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.542,2.499],
"number_observations_unique": 462,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.945
},
{
"type": "R(meas)",
"value": 2.123
},
{
"type": "R(pim)",
"value": 0.839
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.620
}
]
}
]
}