Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4d0a0ef3c5df3e813e60f672efe02ca4",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 86.01,
"b": 145.73,
"c": 107.32,
"alpha": 90.00,
"beta": 95.38,
"gamma": 90.00
},
"wavelengths": [0.99987],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90,2.747],
"number_observations_unique": 67865,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "I/SigI",
"value": 8.44
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [2.91,2.747],
"number_observations_unique": 10720,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.163
},
{
"type": "I/SigI",
"value": 1
},
{
"type": "Completeness",
"value": 96.9
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.396
}
]
}
]
}