Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "16c5ef1f6d272d5185e7e41f3971b2a3",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 44.730,
"b": 46.096,
"c": 110.012,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.01,1.70],
"number_observations": 331177,
"number_observations_unique": 25755,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 24.5
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 12.9
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.73,1.70],
"number_observations": 17556,
"number_observations_unique": 1347,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.687
},
{
"type": "R(meas)",
"value": 2.795
},
{
"type": "R(pim)",
"value": 0.763
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Redundancy",
"value": 13.0
},
{
"type": "CC(1/2)",
"value": 0.638
}
]
}
]
}