Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b3b8bc1c0cbebb427273ecc209775e83",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.233,
"b": 54.418,
"c": 56.730,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.730,1.415],
"number_observations_unique": 25620,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 19.6
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.4
}
]
},
"refln_shells": [
{
"resolution_limits": [1.440,1.415],
"number_observations_unique": 1252,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.662
},
{
"type": "R(pim)",
"value": 0.284
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 98.7
}
]
}
]
}