Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e512d220bc47bc0b273c8b2e32c36aa3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 41.914,
"b": 41.297,
"c": 72.127,
"alpha": 90.00,
"beta": 104.38,
"gamma": 90.00
},
"wavelengths": [1.30510],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.870,1.400],
"number_observations": 249894,
"number_observations_unique": 45248,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 12.400
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.420,1.400],
"number_observations": 11317,
"number_observations_unique": 2171,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.616
},
{
"type": "R(pim)",
"value": 0.765
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 93.800
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.384
}
]
},
{
"resolution_limits": [69.870,7.670],
"number_observations": 1758,
"number_observations_unique": 316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 51.100
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}