Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "db5b5b1957c94af93205ff386eef0afc",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 9.597,
"b": 17.306,
"c": 24.998,
"alpha": 90.00,
"beta": 95.76,
"gamma": 90.00
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,1.7900],
"number_observations_unique": 784,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.217
},
{
"type": "I/SigI",
"value": 4.400
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.800],
"number_observations_unique": 155,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.556
},
{
"type": "Completeness",
"value": 93.400
},
{
"type": "Redundancy",
"value": 2.800
}
]
},
{
"resolution_limits": [2.130,1.940],
"number_observations_unique": 145,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.429
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
{
"resolution_limits": [2.440,2.130],
"number_observations_unique": 159,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.325
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 3.700
}
]
},
{
"resolution_limits": [3.080,2.440],
"number_observations_unique": 159,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.212
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 3.900
}
]
},
{
"resolution_limits": [90.000,3.080],
"number_observations_unique": 166,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.700
}
]
}
]
}