Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f5dcc9e70bce758d3e3b4c492d5db120",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 93.77,
"b": 147.79,
"c": 98.94,
"alpha": 90.00,
"beta": 103.05,
"gamma": 90.00
},
"wavelengths": [0.96860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [77.700,2.290],
"number_observations_unique": 117580,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.350,2.290],
"number_observations_unique": 8706,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.886
},
{
"type": "R(meas)",
"value": 1.015
},
{
"type": "R(pim)",
"value": 0.491
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.557
}
]
}
]
}