Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5a96af0a90149f6b8319c2de9c9e174d",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 83.18,
"b": 83.18,
"c": 132.79,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.020,2.700],
"number_observations": 296155,
"number_observations_unique": 15139,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(meas)",
"value": 0.110
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 23.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.770,2.700],
"number_observations": 22832,
"number_observations_unique": 1106,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.547
},
{
"type": "R(meas)",
"value": 1.586
},
{
"type": "R(pim)",
"value": 0.348
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.600
},
{
"type": "CC(1/2)",
"value": 0.885
}
]
},
{
"resolution_limits": [36.020,12.080],
"number_observations": 2193,
"number_observations_unique": 193,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 48.900
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 11.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}