Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c2e65ff9149399cd5b1ab4f8fe6d4a2c",
"space_group_name": "F 4 3 2",
"unit_cell": {
"a": 177.24,
"b": 177.24,
"c": 177.24,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.310,1.660],
"number_observations": 2221649,
"number_observations_unique": 28740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 33.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 77.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.700,1.660],
"number_observations": 162799,
"number_observations_unique": 2083,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.829
},
{
"type": "R(meas)",
"value": 3.853
},
{
"type": "R(pim)",
"value": 0.434
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 78.200
},
{
"type": "CC(1/2)",
"value": 0.732
}
]
},
{
"resolution_limits": [44.310,7.430],
"number_observations": 25264,
"number_observations_unique": 407,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.004
},
{
"type": "I/SigI",
"value": 107.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 62.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}