Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fb7db836b0a86440621e95897a3b81f0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 54.984,
"b": 98.493,
"c": 58.514,
"alpha": 90.00,
"beta": 107.65,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.520,1.700],
"number_observations": 220799,
"number_observations_unique": 64912,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 15.000
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.700],
"number_observations": 12055,
"number_observations_unique": 3453,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.669
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.788
}
]
},
{
"resolution_limits": [48.520,9.000],
"number_observations": 1563,
"number_observations_unique": 461,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 50.800
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}