Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "565d18075f5e85d83f098d838f7df1a0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 94.185,
"b": 159.818,
"c": 144.059,
"alpha": 90.00,
"beta": 94.94,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.910,3.300],
"number_observations_unique": 63836,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.247
},
{
"type": "I/SigI",
"value": 3.3
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
},
"refln_shells": [
{
"resolution_limits": [3.35,3.300],
"number_observations_unique": 3046,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.768
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Completeness",
"value": 95.3
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.312
}
]
},
{
"resolution_limits": [54.910,8.94],
"number_observations_unique": 3283,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}