Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "20ab1da973146848b92643a933d188a6",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.940,
"b": 52.010,
"c": 79.807,
"alpha": 90.00,
"beta": 92.23,
"gamma": 90.00
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.91,2.49],
"number_observations": 79554,
"number_observations_unique": 12959,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.132
},
{
"type": "R(meas)",
"value": 1.237
},
{
"type": "R(pim)",
"value": 0.491
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.784
}
]
},
"refln_shells": [
{
"resolution_limits": [2.59,2.49],
"number_observations": 8105,
"number_observations_unique": 1307,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.798
},
{
"type": "R(meas)",
"value": 4.133
},
{
"type": "R(pim)",
"value": 1.610
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.296
}
]
}
]
}