Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d315b00be86dc94f154d2ddf88b296d4",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.761,
"b": 62.387,
"c": 147.665,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.01,1.45],
"number_observations": 892481,
"number_observations_unique": 70789,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 12.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.48,1.45],
"number_observations": 32791,
"number_observations_unique": 3451,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.406
},
{
"type": "R(meas)",
"value": 2.542
},
{
"type": "R(pim)",
"value": 0.808
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 9.5
},
{
"type": "CC(1/2)",
"value": 0.427
}
]
}
]
}