Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d1a47f9d89af7873e41105ab59bc2034",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 112.036,
"b": 91.681,
"c": 138.287,
"alpha": 90.000,
"beta": 110.076,
"gamma": 90.000
},
"wavelengths": [0.96800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.74,2.45],
"number_observations_unique": 57756,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.186
},
{
"type": "I/SigI",
"value": 12.1
},
{
"type": "Completeness",
"value": 94.5
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.77,2.45],
"number_observations_unique": 2890,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.854
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 70.2
},
{
"type": "Redundancy",
"value": 14.2
},
{
"type": "CC(1/2)",
"value": 0.496
}
]
}
]
}