Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a0b2470359753c1ac23f6327b13ea7e9",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.595,
"b": 67.858,
"c": 138.609,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.280,1.950],
"number_observations": 320235,
"number_observations_unique": 47309,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.248
},
{
"type": "R(meas)",
"value": 0.269
},
{
"type": "R(pim)",
"value": 0.103
},
{
"type": "I/SigI",
"value": 6.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.950],
"number_observations": 21017,
"number_observations_unique": 3269,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.801
},
{
"type": "R(meas)",
"value": 4.141
},
{
"type": "R(pim)",
"value": 1.626
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.285
}
]
},
{
"resolution_limits": [69.280,8.930],
"number_observations": 3273,
"number_observations_unique": 588,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 42.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.896
}
]
}
]
}