Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a501df170958e0600c19d8d19fea537c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 97.90,
"b": 66.15,
"c": 101.78,
"alpha": 90.00,
"beta": 90.09,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.280,1.720],
"number_observations": 624006,
"number_observations_unique": 137306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 12.100
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.720],
"number_observations": 26377,
"number_observations_unique": 6702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.507
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.792
}
]
},
{
"resolution_limits": [37.280,9.420],
"number_observations": 3331,
"number_observations_unique": 873,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 25.900
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
}
]
}