Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a39a9217a8ca70402f7994e00f079ac5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.550,
"b": 53.060,
"c": 45.338,
"alpha": 90.00,
"beta": 102.35,
"gamma": 90.00
},
"wavelengths": [0.91188],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.95,1.97],
"number_observations": 65649,
"number_observations_unique": 18540,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.02,1.97],
"number_observations": 4566,
"number_observations_unique": 1279,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.182
},
{
"type": "R(meas)",
"value": 2.568
},
{
"type": "R(pim)",
"value": 1.336
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.330
}
]
}
]
}