Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d5ce2eada800f6104d285a34ba958191",
"space_group_name": "P 1",
"unit_cell": {
"a": 57.333,
"b": 91.487,
"c": 150.047,
"alpha": 89.54,
"beta": 90.49,
"gamma": 96.08
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.90],
"number_observations_unique": 230655,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 9.6
},
{
"type": "Completeness",
"value": 96.5
},
{
"type": "Redundancy",
"value": 1.7
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.753
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 92.0
},
{
"type": "Redundancy",
"value": 1.6
},
{
"type": "CC(1/2)",
"value": 0.316
}
]
},
{
"resolution_limits": [2.05,1.97],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.540
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 95.1
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.519
}
]
},
{
"resolution_limits": [2.14,2.05],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.381
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 95.7
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.692
}
]
}
]
}