Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "26214239c112602042a925f76a363869",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 83.33,
"b": 83.33,
"c": 58.93,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.030,1.660],
"number_observations": 116657,
"number_observations_unique": 29800,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 17.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.700,1.660],
"number_observations": 8744,
"number_observations_unique": 2087,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.053
},
{
"type": "R(meas)",
"value": 1.207
},
{
"type": "R(pim)",
"value": 0.578
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.514
}
]
},
{
"resolution_limits": [34.030,7.420],
"number_observations": 1244,
"number_observations_unique": 345,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 47.900
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}