Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1dc87f6db200f999853617fcfb394ec5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 65.91,
"b": 32.85,
"c": 31.64,
"alpha": 90.00,
"beta": 104.45,
"gamma": 90.00
},
"wavelengths": [0.93340],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.030,1.280],
"number_observations_unique": 17055,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 20.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.400
}
]
},
"refln_shells": [
{
"resolution_limits": [1.300,1.280],
"number_observations": 3387,
"number_observations_unique": 876,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.181
},
{
"type": "I/SigI",
"value": 7.200
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 3.900
}
]
},
{
"resolution_limits": [20.030,6.770],
"number_observations": 454,
"number_observations_unique": 125,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 34.800
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 3.600
}
]
}
]
}