Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "83e1e3fd43a648a807ff0a0e7578237a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 109.156,
"b": 52.593,
"c": 46.229,
"alpha": 90.00,
"beta": 101.59,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.23,1.909],
"number_observations_unique": 12730,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 10.2
},
{
"type": "Completeness",
"value": 63.3
},
{
"type": "Redundancy",
"value": 3.1
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,1.909],
"number_observations": 2186,
"number_observations_unique": 636,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.749
},
{
"type": "R(meas)",
"value": 0.886
},
{
"type": "R(pim)",
"value": 0.470
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 3.4
}
]
}
]
}