Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9aa44dde20b494e42616e6a411a5dc0e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.977,
"b": 84.336,
"c": 81.990,
"alpha": 90.00,
"beta": 96.88,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.17,2.40],
"number_observations_unique": 21196,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "I/SigI",
"value": 6.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.98
}
]
},
"refln_shells": [
{
"resolution_limits": [2.49,2.40],
"number_observations_unique": 2207,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.853
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.57
}
]
}
]
}