Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "edceeb74ae173b43ac61a02f165cdc0d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 41.240,
"b": 41.352,
"c": 107.432,
"alpha": 90.00,
"beta": 93.37,
"gamma": 90.00
},
"wavelengths": [1.54178],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.750,2.180],
"number_observations_unique": 18730,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 11.100
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 1.700
}
]
},
"refln_shells": [
{
"resolution_limits": [2.250,2.180],
"number_observations": 3938,
"number_observations_unique": 1307,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.357
},
{
"type": "I/SigI",
"value": 3.100
},
{
"type": "Completeness",
"value": 66.000
},
{
"type": "Redundancy",
"value": 1.300
}
]
},
{
"resolution_limits": [35.750,9.000],
"number_observations": 989,
"number_observations_unique": 306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 36.600
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 1.800
}
]
}
]
}