Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e52a204463474f1d75e010db40d99131",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 73.50,
"b": 42.63,
"c": 156.34,
"alpha": 90.00,
"beta": 94.42,
"gamma": 90.00
},
"wavelengths": [1.54179],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.120,1.950],
"number_observations": 126224,
"number_observations_unique": 68489,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 6.000
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.950],
"number_observations": 8135,
"number_observations_unique": 4400,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.327
},
{
"type": "R(meas)",
"value": 0.454
},
{
"type": "R(pim)",
"value": 0.315
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 93.800
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.763
}
]
},
{
"resolution_limits": [41.120,9.150],
"number_observations": 1215,
"number_observations_unique": 663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 11.300
},
{
"type": "Completeness",
"value": 90.100
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}