Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "84fe15eb0333ec2c46ce39a50b50fc36",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 183.90,
"b": 82.11,
"c": 87.53,
"alpha": 90.00,
"beta": 91.45,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [91.920,2.700],
"number_observations": 245530,
"number_observations_unique": 35976,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "R(meas)",
"value": 0.128
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 13.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.770,2.700],
"number_observations_unique": 2618,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.660
},
{
"type": "R(meas)",
"value": 1.801
},
{
"type": "R(pim)",
"value": 0.693
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.436
}
]
},
{
"resolution_limits": [91.920,12.070],
"number_observations_unique": 432,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}