Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1cb9921100ae6b6989fd25878b9178cf",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 93.394,
"b": 62.097,
"c": 118.470,
"alpha": 90.00,
"beta": 102.22,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.900,2.550],
"number_observations": 109787,
"number_observations_unique": 21961,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 11.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.660,2.550],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.857
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.769
}
]
},
{
"resolution_limits": [45.900,8.820],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}