Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c9b6a3ec9038041a35b5e95468a5e31a",
"space_group_name": "P 1 2 1",
"unit_cell": {
"a": 98.642,
"b": 101.182,
"c": 101.182,
"alpha": 90.00,
"beta": 113.92,
"gamma": 90.00
},
"wavelengths": [0.95374],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.12,2.13],
"number_observations": 649720,
"number_observations_unique": 99650,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.152
},
{
"type": "R(meas)",
"value": 0.166
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 8.6
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.17,2.13],
"number_observations": 16197,
"number_observations_unique": 3013,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.675
},
{
"type": "R(meas)",
"value": 0.742
},
{
"type": "R(pim)",
"value": 0.300
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.732
}
]
}
]
}