Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d9c09ca2302ed3a4ddd0e32a76c8d7a6",
"space_group_name": "P 1",
"unit_cell": {
"a": 44.626,
"b": 46.138,
"c": 50.195,
"alpha": 63.653,
"beta": 86.794,
"gamma": 71.166
},
"wavelengths": [0.98910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.74,2.198],
"number_observations_unique": 16711,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.08127
},
{
"type": "R(meas)",
"value": 0.1006
},
{
"type": "R(pim)",
"value": 0.05835
},
{
"type": "I/SigI",
"value": 8.66
},
{
"type": "Completeness",
"value": 97.04
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.277,2.198],
"number_observations_unique": 1620,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4798
},
{
"type": "R(meas)",
"value": 0.594
},
{
"type": "R(pim)",
"value": 0.3448
},
{
"type": "I/SigI",
"value": 2.00
},
{
"type": "Completeness",
"value": 94.62
},
{
"type": "Redundancy",
"value": 2.00
},
{
"type": "CC(1/2)",
"value": 0.747
}
]
}
]
}