Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cffb73509b81467fca5a2885cecc1bf2",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 61.342,
"b": 61.342,
"c": 146.989,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.961,1.990],
"number_observations": 439051,
"number_observations_unique": 22719,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 20.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.040,1.990],
"number_observations": 32755,
"number_observations_unique": 1674,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.690
},
{
"type": "R(pim)",
"value": 0.391
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.600
},
{
"type": "CC(1/2)",
"value": 0.692
}
]
},
{
"resolution_limits": [49.960,8.910],
"number_observations": 5322,
"number_observations_unique": 312,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 81.300
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 17.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}