Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2dae3ad62b1be12b071efd6484e5b7d8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 64.429,
"b": 60.443,
"c": 71.396,
"alpha": 90.00,
"beta": 109.24,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.729,1.800],
"number_observations": 156654,
"number_observations_unique": 47374,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 12.700
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.840,1.800],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.575
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.734
}
]
},
{
"resolution_limits": [45.000,9.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}