Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "93fccde238386b3d54126bb3e5987224",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 11.480,
"b": 9.552,
"c": 38.582,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,1.850],
"number_observations_unique": 434,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.183
},
{
"type": "Completeness",
"value": 93.900
},
{
"type": "Redundancy",
"value": 5.400
}
]
},
"refln_shells": [
{
"resolution_limits": [1.99,1.85],
"number_observations_unique": 68,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.419
},
{
"type": "Completeness",
"value": 82.90
},
{
"type": "Redundancy",
"value": 6.20
}
]
},
{
"resolution_limits": [2.19,1.99],
"number_observations_unique": 85,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.258
},
{
"type": "Completeness",
"value": 97.70
},
{
"type": "Redundancy",
"value": 5.80
}
]
},
{
"resolution_limits": [2.51,2.19],
"number_observations_unique": 86,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.292
},
{
"type": "Completeness",
"value": 92.50
},
{
"type": "Redundancy",
"value": 5.10
}
]
},
{
"resolution_limits": [3.16,2.51],
"number_observations_unique": 88,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "Completeness",
"value": 97.80
},
{
"type": "Redundancy",
"value": 5.60
}
]
},
{
"resolution_limits": [90.00,3.16],
"number_observations_unique": 107,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "Completeness",
"value": 97.30
},
{
"type": "Redundancy",
"value": 4.60
}
]
}
]
}