Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "39b35c5a6cc18d84b5ab4c3aa2006e52",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 207.547,
"b": 112.035,
"c": 188.179,
"alpha": 90.00,
"beta": 91.21,
"gamma": 90.00
},
"wavelengths": [0.91190],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [188.137,1.717],
"number_observations": 1907492,
"number_observations_unique": 326725,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 11.7
},
{
"type": "Completeness",
"value": 95.4
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.880,1.717],
"number_observations": 93709,
"number_observations_unique": 16337,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.979
},
{
"type": "R(pim)",
"value": 0.444
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.667
}
]
},
{
"resolution_limits": [188.137,5.255],
"number_observations": 90580,
"number_observations_unique": 16335,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 32.2
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}