Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6877d7c80add6dc475e38cd5e12d4737",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 89.117,
"b": 89.117,
"c": 117.945,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [89.120,2.420],
"number_observations": 117127,
"number_observations_unique": 18653,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 14.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.510,2.420],
"number_observations": 12313,
"number_observations_unique": 1915,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.917
},
{
"type": "R(pim)",
"value": 0.804
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.611
}
]
},
{
"resolution_limits": [89.120,9.050],
"number_observations": 2022,
"number_observations_unique": 397,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 48.900
},
{
"type": "Completeness",
"value": 94.700
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}