Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7f48e3762efb0a35bdbaef25a5c097f7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 28.717,
"b": 65.798,
"c": 93.560,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.84999],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.8],
"number_observations_unique": 16791,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 19.3
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 4.5
}
]
},
"refln_shells": [
{
"resolution_limits": [1.86,1.80],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.468
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 80.0
},
{
"type": "Redundancy",
"value": 3.1
}
]
},
{
"resolution_limits": [1.94,1.86],
"quality_factors": [
{
"type": "Completeness",
"value": 95.2
}
]
},
{
"resolution_limits": [2.03,1.94],
"quality_factors": [
{
"type": "Completeness",
"value": 99.8
}
]
},
{
"resolution_limits": [2.13,2.03],
"quality_factors": [
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [2.27,2.13],
"quality_factors": [
{
"type": "Completeness",
"value": 100.0
}
]
},
{
"resolution_limits": [2.44,2.27],
"quality_factors": [
{
"type": "Completeness",
"value": 100.0
}
]
}
]
}