Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b408b660d8bcbff5c99b1b7e81d58da3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 81.884,
"b": 37.549,
"c": 62.400,
"alpha": 90.00,
"beta": 97.23,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.410,1.550],
"number_observations": 42404,
"number_observations_unique": 26181,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 4.400
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 1.600
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [1.580,1.550],
"number_observations_unique": 666,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.663
},
{
"type": "R(meas)",
"value": 0.937
},
{
"type": "R(pim)",
"value": 0.663
},
{
"type": "Completeness",
"value": 49.700
},
{
"type": "Redundancy",
"value": 1.400
},
{
"type": "CC(1/2)",
"value": 0.407
}
]
},
{
"resolution_limits": [19.410,8.490],
"number_observations_unique": 160,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "Completeness",
"value": 82.400
},
{
"type": "Redundancy",
"value": 1.600
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
}
]
}