Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "064c4fa900522ab72f3c9f34a600c77c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.475,
"b": 87.389,
"c": 63.414,
"alpha": 90.00,
"beta": 90.09,
"gamma": 90.00
},
"wavelengths": [0.97934],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.72],
"number_observations_unique": 51343,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 38.8
},
{
"type": "Completeness",
"value": 97.2
},
{
"type": "Redundancy",
"value": 5.7
}
]
},
"refln_shells": [
{
"resolution_limits": [1.75,1.72],
"number_observations_unique": 2628,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.182
},
{
"type": "R(meas)",
"value": 0.204
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 7.932
},
{
"type": "CC(1/2)",
"value": 0.954
}
]
}
]
}