Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9f05e2cceaca8484c54289f651bdc5d8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 52.920,
"b": 93.502,
"c": 97.200,
"alpha": 90.00,
"beta": 97.37,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.12,2.52],
"number_observations": 131448,
"number_observations_unique": 25960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "R(meas)",
"value": 0.172
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 81.3
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.962
}
]
},
"refln_shells": [
{
"resolution_limits": [2.65,2.52],
"number_observations": 5161,
"number_observations_unique": 2139,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.830
},
{
"type": "R(meas)",
"value": 1.081
},
{
"type": "R(pim)",
"value": 0.678
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.453
}
]
}
]
}