Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a91ffa0bf579ea88faa11dd3d5074a1d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 16.590,
"b": 4.789,
"c": 40.229,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,1.600],
"number_observations_unique": 503,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "I/SigI",
"value": 6.462
},
{
"type": "Completeness",
"value": 92.600
},
{
"type": "Redundancy",
"value": 4.500
}
]
},
"refln_shells": [
{
"resolution_limits": [1.72,1.60],
"number_observations_unique": 78,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.499
},
{
"type": "Completeness",
"value": 85.70
},
{
"type": "Redundancy",
"value": 2.80
}
]
},
{
"resolution_limits": [1.90,1.72],
"number_observations_unique": 86,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.422
},
{
"type": "Completeness",
"value": 87.80
},
{
"type": "Redundancy",
"value": 2.90
}
]
},
{
"resolution_limits": [2.17,1.90],
"number_observations_unique": 101,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.239
},
{
"type": "Completeness",
"value": 93.50
},
{
"type": "Redundancy",
"value": 4.60
}
]
},
{
"resolution_limits": [2.74,2.17],
"number_observations_unique": 108,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.221
},
{
"type": "Completeness",
"value": 94.70
},
{
"type": "Redundancy",
"value": 5.70
}
]
},
{
"resolution_limits": [90.00,2.74],
"number_observations_unique": 130,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "Completeness",
"value": 98.50
},
{
"type": "Redundancy",
"value": 5.40
}
]
}
]
}