Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d1fbece825f1cc23db82fcc77c0a21f5",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 101.400,
"b": 102.332,
"c": 125.909,
"alpha": 90.00,
"beta": 106.53,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.350,1.700],
"number_observations_unique": 265575,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 13.300
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.460
},
{
"type": "Completeness",
"value": 90.300
},
{
"type": "Redundancy",
"value": 2.700
}
]
},
{
"resolution_limits": [60.350,9.310],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "Completeness",
"value": 81.200
},
{
"type": "Redundancy",
"value": 3.200
}
]
}
]
}