Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4cb221419f93049a5d8afaf29a66a148",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 33.219,
"b": 42.315,
"c": 49.391,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.820,1.450],
"number_observations": 39913,
"number_observations_unique": 12697,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 17.500
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.470,1.450],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.556
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [19.820,7.940],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "Completeness",
"value": 90.500
},
{
"type": "Redundancy",
"value": 2.900
}
]
}
]
}